data/tahoe_drugs_drug_info.csv

pubchem_id,iupac_name,common_name,molecular_formula,molecular_weight,canonical_smiles,synonyms
165411828,"trimagnesium;1,3,5,7-tetraoxido-2,4,6,8,9,10-hexaoxa-1,3,5,7-tetrasilatricyclo[3.3.1.13,7]decane;dihydroxide",STERITALC,H2Mg3O12Si4,379.27,[OH-].[OH-].[O-][Si]12O[Si]3(O[Si](O1)(O[Si](O2)(O3)[O-])[O-])[O-].[Mg+2].[Mg+2].[Mg+2],"['STERITALC', 'Talc [JAN]', 'TALC [VANDF]', 'TALC [HSDB]', 'TALC [FCC]', 'TALC [WHO-DD]', 'TALC [WHO-IP]', 'TALC [II]', 'TALC [MI]', 'PULVIS TALCI [CHP]']"
387447,[(1R)-3-methyl-1-[[(2S)-3-phenyl-2-(pyrazine-2-carbonylamino)propanoyl]amino]butyl]boronic acid,DPBA,C19H25BN4O4,384.2,B(C(CC(C)C)NC(=O)C(CC1=CC=CC=C1)NC(=O)C2=NC=CN=C2)(O)O,"['Bortezomib', '179324-69-7', 'Bortezomib accord', 'NSC-681239', 'Peptide boronate', 'MLN-341', 'PS 341 (pharmaceutical)', 'UNII-69G8BD63PP', '69G8BD63PP', 'N-[(1R)-1-(DIHYDROXYBORYL)-3-METHYLBUTYL]-N-(PYRAZIN-2-YLCARBONYL)-L-PHENYLALANINAMIDE']"
25183872,"[(1R)-1-[[2-[(2,5-dichlorobenzoyl)amino]acetyl]amino]-3-methylbutyl]boronic acid",Ixazomib,C14H19BCl2N2O4,361.0,B(C(CC(C)C)NC(=O)CNC(=O)C1=C(C=CC(=C1)Cl)Cl)(O)O,"['Ixazomib', '1072833-77-2', 'MLN-2238', 'MLN 2238', 'MLN-9708 FREE BASE', 'UNII-71050168A2', 'CHEBI:90942', 'Boronic acid, b-((1R)-1-((2-((2,5-dichlorobenzoyl)amino)acetyl)amino)-3-methylbutyl)-', '71050168A2', '((1R)-1-((2,5-DICHLOROBENZAMIDO)ACETAMIDO)-3-METHYLBUTYL)BORONIC ACID']"
56844015,"2-[4-(carboxymethyl)-2-[(1R)-1-[[2-[(2,5-dichlorobenzoyl)amino]acetyl]amino]-3-methylbutyl]-5-oxo-1,3,2-dioxaborolan-4-yl]acetic acid",NINLARO,C20H23BCl2N2O9,517.1,B1(OC(=O)C(O1)(CC(=O)O)CC(=O)O)C(CC(C)C)NC(=O)CNC(=O)C2=C(C=CC(=C2)Cl)Cl,"['Ixazomib citrate', '1239908-20-3', 'NINLARO', 'Ixazomib citrate (Ester)', 'UNII-46CWK97Z3K', '46CWK97Z3K', '1,3,2-Dioxaborolane-4,4-diacetic acid, 2-[(1R)-1-[[2-[(2,5-dichlorobenzoyl)amino]acetyl]amino]-3-methylbutyl]-5-oxo-', 'CHEBI:90939', '1,3,2-Dioxaborolane-4,4-diacetic acid, 2-((1R)-1-((2-((2,5-dichlorobenzoyl)amino)acetyl)amino)-3-methylbutyl)-5-oxo-', 'mln9708']"
168311648,calcium;2-hydroxypropanoate;methane,Lactate (calcium),C4H9CaO3+,145.19,C.CC(C(=O)[O-])O.[Ca+2],['Lactate (calcium)']
168312271,(E)-but-2-enedioic acid;methane;1-(propan-2-ylamino)-3-[4-(2-propan-2-yloxyethoxymethyl)phenoxy]propan-2-ol,Bisoprolol (hemifumarate),C23H39NO8,457.6,C.CC(C)NCC(COC1=CC=C(C=C1)COCCOC(C)C)O.C(=CC(=O)O)C(=O)O,['Bisoprolol (hemifumarate)']
444972,(E)-but-2-enedioic acid,Boletate,C4H4O4,116.07,C(=CC(=O)O)C(=O)O,"['fumaric acid', '110-17-8', 'trans-Butenedioic acid', 'Allomaleic acid', 'Boletic acid', 'Lichenic acid', '(2E)-but-2-enedioic acid', 'Tumaric acid', 'trans-1,2-Ethylenedicarboxylic acid', '(E)-2-Butenedioic acid']"
3657,hydroxyurea,HU,CH4N2O2,76.055,C(=O)(N)NO,"['hydroxyurea', '127-07-1', 'Hydroxycarbamide', 'Hydrea', '1-HYDROXYUREA', 'Urea, hydroxy-', 'Droxia', 'Hydroxylurea', 'Hydreia', 'Litaler']"
16048568,"(2S)-2,5-diamino-2-(difluoromethyl)pentanoic acid;hydrochloride",G16520,C6H13ClF2N2O2,218.63,C(CC(C(F)F)(C(=O)O)N)CN.Cl,"['L-Eflornithine (monohydrochloride)', '69955-42-6', 'L-Eflornithine monohydrochloride', '(2S)-2,5-diamino-2-(difluoromethyl)pentanoic acid;hydrochloride', '(S)-2,5-diamino-2-(difluoromethyl)pentanoic acid hydrochloride', 'L-DFMO (monohydrochloride)', 'SCHEMBL1322403', 'HY-B0744D', 'VKDGNNYJFSHYKD-FYZOBXCZSA-N', 'AKOS040733573']"
9082,2-aminoethanethiol;hydrochloride,Bekaptan,C2H8ClNS,113.61,C(CS)N.Cl,"['Cysteamine hydrochloride', '156-57-0', '2-Aminoethanethiol hydrochloride', 'Cysteamine HCl', 'Cysteaminium chloride', 'Bekaptan', 'ETHANETHIOL, 2-AMINO-, HYDROCHLORIDE', 'Mercaptoethylamine hydrochloride', 'Merkamin hydrochloride', 'Mercamine hydrochloride']"
11683005,(2S)-2-amino-5-[[(2R)-1-(carboxymethylamino)-3-dimethylarsanylsulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid,Zinapar,C12H22AsN3O6S,411.31,C[As](C)SCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N,"['Darinaparsin', '69819-86-9', 'ZIO 101', 'ZIO-101', 'Zinapar', 'clarinaparsin', 'DMAs(III)G', 'Darinaparsin [USAN]', 'DMAs(III)SG', 'Darinaparsina']"
135526609,"2-amino-9-[(1S,3R,4S)-4-hydroxy-3-(hydroxymethyl)-2-methylidenecyclopentyl]-1H-purin-6-one;hydrate",Baraclud,C12H17N5O4,295.29,C=C1C(CC(C1CO)O)N2C=NC3=C2N=C(NC3=O)N.O,"['Entecavir hydrate', 'entecavir monohydrate', '209216-23-9', 'Entecavir hydrate (JAN)', 'Entecavir (USP)', 'ENTECAVIR HYDRATE [JAN]', 'ENTECAVIR MONOHYDRATE [MI]', 'ENTECAVIR MONOHYDRATE [WHO-DD]', '2-amino-9-[(1S,3R,4S)-4-hydroxy-3-(hydroxymethyl)-2-methylidenecyclopentyl]-1,9-dihydro-6H-purin-6-one--water (1/1)', '2-amino-9-((1S,3R,4S)-4-hydroxy-3-(hydroxymethyl)-2-methylidenecyclopentyl)-1,9-dihydro-6H-purin-6-one--water (1/1)']"
204,"(2,5-dioxoimidazolidin-4-yl)urea",SEUK,C4H6N4O3,158.12,C1(C(=O)NC(=O)N1)NC(=O)N,"['allantoin', '97-59-6', '5-Ureidohydantoin', 'Glyoxyldiureide', 'Cordianine', 'Glyoxyldiureid', 'Allantol', 'Alantan', 'AVC/Dienestrolcream', 'Urea, (2,5-dioxo-4-imidazolidinyl)-']"
3385,"5-fluoro-1H-pyrimidine-2,4-dione",FU,C4H3FN2O2,130.08,C1=C(C(=O)NC(=O)N1)F,"['5-Fluorouracil', 'fluorouracil', '5-FU', 'Fluracil', 'Fluoroblastin', 'Queroplex', '5-fluoropyrimidine-2,4(1H,3H)-dione', 'Phthoruracil', 'Carzonal', 'Kecimeton']"
23665037,"sodium;(2S)-2-amino-3-[4-(4-hydroxy-3,5-diiodophenoxy)-3,5-diiodophenyl]propanoate;pentahydrate",Nanoplast,C15H20I4NNaO9,888.93,C1=C(C=C(C(=C1I)OC2=CC(=C(C(=C2)I)O)I)I)CC(C(=O)[O-])N.O.O.O.O.O.[Na+],"['L-Thyroxine sodium salt pentahydrate', 'Melamine/formaldehyde resin', 'Nanoplast', 'Cassurit MT', 'Cohedur A', 'Cassurit HML', 'Cassurit MLP', 'Cassurit MLS', 'Melamine, polymer with formaldehyde', 'Budamin MF 55I']"
370,"3,4,5-trihydroxybenzoic acid",GDE,C7H6O5,170.12,C1=C(C=C(C(=C1O)O)O)C(=O)O,"['Gallic acid', 'Gallic acid, tech.', 'Kyselina gallova', 'Pyrogallol-5-carboxylic acid', 'HSDB 2117', 'CCRIS 5523', 'NSC 674319', 'CHEBI:30778', 'Kyselina 3,4,5-trihydroxybenzoova', 'AI3-16412']"
24721416,"3,4,5-trihydroxybenzoic acid;hydrate",AT30909,C7H8O6,188.13,C1=C(C=C(C(=C1O)O)O)C(=O)O.O,"['Gallic acid monohydrate', '3,4,5-Trihydroxybenzoic acid monohydrate', 'Gallic acid, monohydrate', 'UNII-48339473OT', 'Benzoic acid, 3,4,5-trihydroxy-, monohydrate', '48339473OT', 'Acidum Gallicum', '5995-86-8', '3,4,5-trihydroxybenzoic acid hydrate', 'Gallicum acidum']"
118959080,4-(2-bromo-6-fluorobenzoyl)-N-pyridin-3-yl-1H-pyrrole-2-carboxamide,9N8,C17H11BrFN3O2,388.2,C1=CC(=C(C(=C1)Br)C(=O)C2=CNC(=C2)C(=O)NC3=CN=CC=C3)F,"['ERK5-IN-2', '1888305-96-1', '4-(2-Bromo-6-fluorobenzoyl)-N-(pyridin-3-yl)-1H-pyrrole-2-carboxamide', 'CHEMBL4436895', '4-(2-bromo-6-fluorobenzoyl)-N-pyridin-3-yl-1H-pyrrole-2-carboxamide', '4-(2-bromanyl-6-fluoranyl-phenyl)carbonyl-~{N}-pyridin-3-yl-1~{H}-pyrrole-2-carboxamide', 'MFCD32174287', 'C17H11BrFN3O2', 'ERK5-IN-2?', 'SCHEMBL17607180']"
10184665,"4-[(1R)-2-[6-[2-[(2,6-dichlorophenyl)methoxy]ethoxy]hexylamino]-1-hydroxyethyl]-2-(hydroxymethyl)phenol",Vilanterol,C24H33Cl2NO5,486.4,C1=CC(=C(C(=C1)Cl)COCCOCCCCCCNCC(C2=CC(=C(C=C2)O)CO)O)Cl,"['Vilanterol', '503068-34-6', 'GW642444x', 'GW-642444x', 'UNII-028LZY775B', 'vilanterolum', 'CHEBI:75037', 'Vilanterol [USAN:INN]', 'GW642444', 'GW 642444']"
14992,2-aminoethanol;5-chloro-N-(2-chloro-4-nitrophenyl)-2-hydroxybenzamide,Mollutox,C15H15Cl2N3O5,388.2,C1=CC(=C(C=C1[N+](=O)[O-])Cl)NC(=O)C2=C(C=CC(=C2)Cl)O.C(CO)N,"['1420-04-8', 'Niclosamide-olamine', 'Clonitralid', 'Niclosamide ethanolamine salt', 'Bayluscide', 'CLONITRALIDE', '5-chloro-N-(2-chloro-4-nitrophenyl)-2-hydroxybenzamide compound with 2-aminoethanol (1:1)', 'Niclosamide-olamine [ISO]', 'Niclosamide olamine', '5-Chloro-N-(2-chloro-4-nitrophenyl)-2-hydroxybenzamide 2-aminoethanol salt']"
11672905,"4-[(1R)-2-amino-1-hydroxyethyl]benzene-1,2-diol;hydrochloride",ATERENOL,C8H12ClNO3,205.64,C1=CC(=C(C=C1C(CN)O)O)O.Cl,"['L-Noradrenaline hydrochloride', 'NORADRENALINE HYDROCHLORIDE', '(-)-Norepinephrine hydrochloride', 'L-Norepinephrine hydrochloride', 'ATERENOL', 'Arterenol hydrochloride', 'NORADRENALINE HYDROCHLORIDE [MI]', 'R-(-)-NORADRENALINE HYDROCHLORIDE', 'NORADRENALINE HYDROCHLORIDE [MART.]', 'R-(-)-NOREPINEPHRINE MONOHYDROCHLORIDE']"
5564,"5-chloro-2-(2,4-dichlorophenoxy)phenol",TCS,C12H7Cl3O2,289.5,C1=CC(=C(C=C1Cl)O)OC2=C(C=C(C=C2)Cl)Cl,"['triclosan', '3380-34-5', '5-CHLORO-2-(2,4-DICHLOROPHENOXY)PHENOL', 'Cloxifenolum', ""2,4,4'-Trichloro-2'-hydroxydiphenyl ether"", 'Triclosanum', 'Stri-Dex Cleansing Bar', 'CH 3565', 'Lexol 300', '5-Chloro-2-(2,4-dichloro-phenoxy)-phenol']"
51082,"1,4-dihydroxy-5,8-bis[2-(2-hydroxyethylamino)ethylamino]anthracene-9,10-dione;dihydrochloride",DHAD,C22H30Cl2N4O6,517.4,C1=CC(=C2C(=C1NCCNCCO)C(=O)C3=C(C=CC(=C3C2=O)O)O)NCCNCCO.Cl.Cl,"['Mitoxantrone hydrochloride', 'Novantrone', 'DHAD', 'Ralenova', 'Mitozantrone hydrochloride', 'DHAQ', 'CL 232,315', 'U6USW86RD0', 'CHEBI:50727', 'CL 232315']"
8813,4-[5-(4-carbamimidoylphenoxy)pentoxy]benzenecarboximidamide;2-hydroxyethanesulfonic acid,PENTAM,C23H36N4O10S2,592.7,C1=CC(=CC=C1C(=N)N)OCCCCCOC2=CC=C(C=C2)C(=N)N.C(CS(=O)(=O)O)O.C(CS(=O)(=O)O)O,"['PENTAMIDINE ISETHIONATE', ""4,4'-(Pentane-1,5-diylbis(oxy))dibenzimidamide bis(2-hydroxyethanesulfonate)"", 'Pentamidine diisethionate', 'Pentamidine diisetionate', 'Lomidin', 'Pneumopent', 'Lomidine isoethionate', 'Pentamidine isothionate', 'RP 2512', ""4,4'-(Pentamethylenedioxy)dibenzamidine bis(2-hydroxyethanesulfonate)""]"
135398658,(2S)-2-[[4-[(2-amino-4-oxo-3H-pteridin-6-yl)methylamino]benzoyl]amino]pentanedioic acid,PGA,C19H19N7O6,441.4,C1=CC(=CC=C1C(=O)NC(CCC(=O)O)C(=O)O)NCC2=CN=C3C(=N2)C(=O)NC(=N3)N,"['folic acid', '59-30-3', 'Pteroylglutamic acid', 'PteGlu', 'Folacid', 'Folicet', 'Incafolic', 'Folettes', 'Foliamin', 'Folipac']"
92044433,disodium;3-[[4-[(3-carboxy-4-oxidophenyl)diazenyl]benzoyl]amino]propanoate;dihydrate,CS-4522,C17H17N3Na2O8,437.3,C1=CC(=CC=C1C(=O)NCCC(=O)[O-])N=NC2=CC(=C(C=C2)[O-])C(=O)O.O.O.[Na+].[Na+],"['Balsalazide (sodium hydrate)', 'HY-B0667A', 'CS-4522']"
445154,"5-[(E)-2-(4-hydroxyphenyl)ethenyl]benzene-1,3-diol",STL,C14H12O3,228.24,C1=CC(=CC=C1C=CC2=CC(=CC(=C2)O)O)O,"['resveratrol', '501-36-0', 'trans-resveratrol', ""3,4',5-Trihydroxystilbene"", '(E)-resveratrol', 'Resvida', ""3,4',5-Stilbenetriol"", ""3,4',5-Trihydroxy-trans-stilbene"", '5-[(1E)-2-(4-Hydroxyphenyl)ethenyl]-1,3-benzenediol', 'Biofort']"
118701008,5-(6-aminopyridin-3-yl)-3-(4-chlorophenyl)pyridin-2-amine,s6499,C16H13ClN4,296.75,C1=CC(=CC=C1C2=C(N=CC(=C2)C3=CN=C(C=C3)N)N)Cl,"['1811510-56-1', 'PF-06260933', 'PF-6260933', ""5-(4-Chlorophenyl)-[3,3'-bipyridine]-6,6'-diamine"", ""5-(4-Chlorophenyl)-[3,3']bipyridinyl-6,6'-diamine"", '5-(6-aminopyridin-3-yl)-3-(4-chlorophenyl)pyridin-2-amine', 'CHEMBL3754515', 'PF06260933', 'GTPL13265', 'TQR1219']"
107971,"3-(4-hydroxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one",DZN,C21H20O9,416.4,C1=CC(=CC=C1C2=COC3=C(C2=O)C=CC(=C3)OC4C(C(C(C(O4)CO)O)O)O)O,"['Daidzin', '552-66-9', 'Daidzoside', 'Daidzein 7-O-glucoside', 'Daidzein 7-glucoside', 'Daidzein-7-glucoside', 'daidzein 7-O-beta-D-glucoside', '7-(beta-D-Glucopyranosyloxy)-3-(4-hydroxyphenyl)-4H-1-benzopyran-4-one', 'UNII-4R2X91A5M5', 'BRN 0059741']"
135410875,"(2S)-2-[[4-[2-(2-amino-4-oxo-3,7-dihydropyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoyl]amino]pentanedioic acid",LYA,C20H21N5O6,427.4,C1=CC(=CC=C1CCC2=CNC3=C2C(=O)NC(=N3)N)C(=O)NC(CCC(=O)O)C(=O)O,"['Pemetrexed', '137281-23-3', 'CHEBI:63616', 'UNII-04Q9AIZ7NO', '04Q9AIZ7NO', 'NSC-698037', 'PEMFEXY', 'HSDB 7316', 'L-Glutamic acid, N-[4-[2-(2-amino-4,7-dihydro-4-oxo-3H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoyl]-', 'DTXSID2048329']"
3198,"1-[2-[(4-chlorophenyl)methoxy]-2-(2,4-dichlorophenyl)ethyl]imidazole",Econazol,C18H15Cl3N2O,381.7,C1=CC(=CC=C1COC(CN2C=CN=C2)C3=C(C=C(C=C3)Cl)Cl)Cl,"['econazole', '27220-47-9', 'Econazolum', 'Econazol', '(+-)-Econazole', 'UNII-6Z1Y2V4A7M', 'NSC 187789', 'NSC-187789', '6Z1Y2V4A7M', 'CCRIS 9032']"
135397144,"2-[[3,4-bis[(4-fluorophenyl)methoxy]phenyl]methylamino]ethanol;hydrochloride",s8756,C23H24ClF2NO3,435.9,C1=CC(=CC=C1COC2=C(C=C(C=C2)CNCCO)OCC3=CC=C(C=C3)F)F.Cl,"['XRK3F2', '2375193-43-2', '2-((3,4-Bis((4-fluorobenzyl)oxy)benzyl)amino)ethanol hydrochloride', '2-[[3,4-bis[(4-fluorophenyl)methoxy]phenyl]methylamino]ethanol;hydrochloride', 'MFCD31812777', 'C23H24ClF2NO3', 'XRK3F2?', 'CHEMBL4643149', 'GLXC-20930', 's8756']"
440936,"(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(4-hydroxyphenoxy)oxane-3,4,5-triol",Ursi,C12H16O7,272.25,C1=CC(=CC=C1O)OC2C(C(C(C(O2)CO)O)O)O,"['arbutin', '497-76-7', 'Arbutoside', 'Ursin', 'Uvasol', 'beta-Arbutin', 'p-Arbutin', 'p-Hydroxyphenyl beta-D-glucoside', 'Arbutine', 'Arbutinum']"
12136798,N-(2-amino-4-fluorophenyl)-4-[[[(E)-3-pyridin-3-ylprop-2-enoyl]amino]methyl]benzamide,Epidaza,C22H19FN4O2,390.4,C1=CC(=CN=C1)C=CC(=O)NCC2=CC=C(C=C2)C(=O)NC3=C(C=C(C=C3)F)N,"['tucidinostat', '1616493-44-7', 'Epidaza', 'HBI-8000', 'CS-055', 'CS055', '(E)-N-(2-amino-4-fluorophenyl)-4-((3-(pyridin-3-yl)acrylamido)methyl)benzamide', 'Tucidinostat [USAN]', 'Chidamide [WHO-DD]', 'Epidaza in China']"
73053710,"5-[(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)methyl]-N-[[6-(trifluoromethyl)pyridin-3-yl]methyl]pyridin-2-amine;hydrochloride",FP-113,C20H16Cl2F3N5,454.3,C1=CC(=NC=C1CC2=CNC3=C2C=C(C=N3)Cl)NCC4=CN=C(C=C4)C(F)(F)F.Cl,"['Pexidartinib hydrochloride', '2040295-03-0', 'PLX3397 HCl', 'YS6WAI3XN7', 'PLX-3397 HCL', 'UNII-YS6WAI3XN7', 'FP-113', 'PLX3397 HYDROCHLORIDE', '5-((5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)methyl)-N-((6-(trifluoromethyl)pyridin-3-yl)methyl)pyridin-2-amine hydrochloride', 'PLX-3397 HYDROCHLORIDE']"
16760658,sodium;2-hydroxybenzoate,Clin,C7H5NaO3,160.10,C1=CC=C(C(=C1)C(=O)[O-])O.[Na+],"['Sodium salicylate', '54-21-7', 'Sodium 2-hydroxybenzoate', 'Enterosalicyl', 'Kerasalicyl', 'Salsonin', 'Alysine', 'Clin', 'Enterosalil', 'Entrosalyl']"
338,2-hydroxybenzoic acid,SAX,C7H6O3,138.12,C1=CC=C(C(=C1)C(=O)O)O,"['salicylic acid', '2-Hydroxybenzoic acid', 'o-hydroxybenzoic acid', '2-Carboxyphenol', 'o-Carboxyphenol', 'Rutranex', 'Salonil', 'Retarder W', 'Duoplant', 'Psoriacid-S-stift']"
11219835,"3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoic acid",JBF,C15H9FN2O3,284.24,C1=CC=C(C(=C1)C2=NC(=NO2)C3=CC(=CC=C3)C(=O)O)F,"['Ataluren', '775304-57-9', 'PTC124', '3-(5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl)benzoic acid', '3-[5-(2-Fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoic acid', 'PTC-124', 'Translarna', 'Ataluren [USAN]', 'Atalureno', 'Ataluren [USAN:INN]']"
5717952,"(2E)-2-[[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]hydrazinylidene]-3-(2-nitrophenyl)propanoic acid",4tpw,C18H12Cl2N4O4S,451.3,C1=CC=C(C(=C1)CC(=NNC2=NC(=CS2)C3=CC(=C(C=C3)Cl)Cl)C(=O)O)[N+](=O)[O-],"['4egi-1', '315706-13-9', '(2E)-2-[[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]hydrazinylidene]-3-(2-nitrophenyl)propanoic acid', '(Z)-4EGI-1', 'CID 5717952', '(2e)-2-{2-[4-(3,4-Dichlorophenyl)-1,3-Thiazol-2-Yl]hydrazinylidene}-3-(2-Nitrophenyl)propanoic Acid', '4tpw', 'MFCD02330020', 'CHEMBL3310197', 'SCHEMBL12081677']"
2812,1-[(2-chlorophenyl)-diphenylmethyl]imidazole,CLOT,C22H17ClN2,344.8,C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3Cl)N4C=CN=C4,"['clotrimazole', '23593-75-1', 'Clotrimazol', 'Mycosporin', 'Empecid', 'Mykosporin', 'Gyne lotrimin', 'Chlotrimazole', 'Trimysten', 'Gyne-Lotrimin']"
23679632,"sodium;5-oxo-4,4-diphenyl-1H-imidazol-2-olate",Antisacer,C15H11N2NaO2,274.25,C1=CC=C(C=C1)C2(C(=O)NC(=N2)[O-])C3=CC=CC=C3.[Na+],"['Phenytoin (sodium)', 'Antisacer', 'Phenytoin sodium,prompt', '5,5-Diphenyl Hydantoin Sodium', 'Phenytoin sodium extended', 'Phenytoin sodium,extended', 'PHENYTOIN SODIUM, PROMPT', 'PHENYTOIN SODIUM, EXTENDED', 'sodium 2,5-dioxo-4,4-diphenylimidazolidin-1-ide', 'Phenytoin soluble']"
121241171,6-chloro-3-[(E)-3-(5-fluoropyridin-3-yl)prop-2-enoyl]-4-phenyl-1H-quinolin-2-one,s8181,C23H14ClFN2O2,404.8,C1=CC=C(C=C1)C2=C(C(=O)NC3=C2C=C(C=C3)Cl)C(=O)C=CC4=CC(=CN=C4)F,"['SBI-756', '110-696-9', '1997370-71-4', 'SBI-0640756', '1821280-29-8', '(E)-6-Chloro-3-(3-(5-fluoropyridin-3-yl)acryloyl)-4-phenylquinolin-2(1H)-one', '6-chloro-3-[(E)-3-(5-fluoropyridin-3-yl)prop-2-enoyl]-4-phenyl-1H-quinolin-2-one', '2205871-61-8', 'SCHEMBL19857722', 'SCHEMBL19857734']"
4614,"3-(4,5-diphenyl-1,3-oxazol-2-yl)propanoic acid",Alvo,C18H15NO3,293.3,C1=CC=C(C=C1)C2=C(OC(=N2)CCC(=O)O)C3=CC=CC=C3,"['oxaprozin', '21256-18-8', '3-(4,5-Diphenyloxazol-2-yl)propanoic acid', '3-(4,5-Diphenyl-1,3-oxazol-2-yl)propanoic acid', 'Alvo', 'Oxaprozine', 'Oxaprozinum', 'Deflam', 'Oxaprozina', 'Voir']"
64982,"(2S,3S,4S,5R,6S)-6-(5,6-dihydroxy-4-oxo-2-phenylchromen-7-yl)oxy-3,4,5-trihydroxyoxane-2-carboxylic acid",Baicalin,C21H18O11,446.4,C1=CC=C(C=C1)C2=CC(=O)C3=C(C(=C(C=C3O2)OC4C(C(C(C(O4)C(=O)O)O)O)O)O)O,"['Baicalin', '21967-41-9', 'Baicalein 7-O-glucuronide', '7-D-Glucuronic acid-5,6-dihydroxyflavone', 'Baicalein 7-glucuronide', 'CHEBI:2981', '347Q89U4M5', '5,6-dihydroxy-4-oxo-2-phenyl-4H-chromen-7-yl beta-D-glucopyranosiduronic acid', '7-D-glucuronic acid-5,6-dihydroxy-flavone', 'UNII-347Q89U4M5']"
6918638,(E)-N-hydroxy-3-[3-(phenylsulfamoyl)phenyl]prop-2-enamide,Beleodaq,C15H14N2O4S,318.3,C1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C=CC(=O)NO,"['Belinostat', '866323-14-0', 'Beleodaq', 'PXD-101', 'E-Belinostat', 'NSC726630', 'PX-105684', 'UNII-F4H96P17NZ', 'F4H96P17NZ', 'CHEBI:61076']"
2554,benzo[b][1]benzazepine-11-carboxamide,CBZ,C15H12N2O,236.27,C1=CC=C2C(=C1)C=CC3=CC=CC=C3N2C(=O)N,"['carbamazepine', '298-46-4', 'Carbamazepen', 'Biston', 'Equetro', 'Tegretal', '5H-Dibenz[b,f]azepine-5-carboxamide', '5H-Dibenzo[b,f]azepine-5-carboxamide', 'Carbazepine', 'Timonil']"
1936439,"N-(12-cyanoindolizino[2,3-b]quinoxalin-2-yl)thiophene-2-carboxamide",s6882,C20H11N5OS,369.4,C1=CC=C2C(=C1)N=C3C(=C4C=C(C=CN4C3=N2)NC(=O)C5=CC=CS5)C#N,"['487020-03-1', 'HI-TOPK-032', 'VH977A8H53', '2-Thiophenecarboxamide, N-(12-cyanoindolizino(2,3-b)quinoxalin-2-yl)-', 'N-(12-Cyanoindolizino(2,3-b)quinoxalin-2-yl)-2-thiophenecarboxamide', 'HI TOPK 032', 'HI-TOPK-32', 'N-(12-cyanoindolizino[2,3-b]quinoxalin-2-yl)thiophene-2-carboxamide', 'N-(12-Cyanindolizino[2,3-b]quinoxalin-2-yl)-2-thiophenecarboxamide', 'N-{12-CYANOINDOLIZINO[2,3-B]QUINOXALIN-2-YL}THIOPHENE-2-CARBOXAMIDE']"
1923,quinolin-8-ol,HQY,C9H7NO,145.16,C1=CC2=C(C(=C1)O)N=CC=C2,"['8-HYDROXYQUINOLINE', 'quinolin-8-ol', '148-24-3', 'Oxyquinoline', 'Oxine', 'Quinophenol', 'Oxychinolin', '8-Quinol', '8-Oxyquinoline', 'Phenopyridine']"
6419992,"6-(trifluoromethoxy)-1,3-benzothiazol-2-amine;hydrochloride",HB0548,C8H6ClF3N2OS,270.66,C1=CC2=C(C=C1OC(F)(F)F)SC(=N2)N.Cl,"['Riluzole hydrochloride', '850608-87-6', '2-Amino-6-trifluoromethoxybenzothiazole hydrochloride', '6-(trifluoromethoxy)-1,3-benzothiazol-2-amine;hydrochloride', '6-(Trifluoromethoxy)benzo[d]thiazol-2-amine hydrochloride', 'SMR000449311', 'SR-01000002997', 'PK 26124', 'Prestwick_644', 'CPD000449311']"
130956,"(1-hydroxy-2-imidazo[1,2-a]pyridin-3-yl-1-phosphonoethyl)phosphonic acid",Onobis,C9H12N2O7P2,322.15,C1=CC2=NC=C(N2C=C1)CC(O)(P(=O)(O)O)P(=O)(O)O,"['Minodronic acid', 'Minodronate', '180064-38-4', '127657-42-5', 'BPH 261', 'ONO 5920', 'Minodronic acid [INN]', 'Ono-5920', 'YH 529', 'YM 529']"
23582824,"(5Z)-5-[(4-pyridin-4-ylquinolin-6-yl)methylidene]-1,3-thiazolidine-2,4-dione",s1360,C18H11N3O2S,333.4,C1=CC2=NC=CC(=C2C=C1C=C3C(=O)NC(=O)S3)C4=CC=NC=C4,"['GSK1059615', 'GSK-1059615', 'GSK 1059615', 'GSK-615', 'GSK615', 'UNII-07YMO87363', '(5Z)-5-[(4-pyridin-4-ylquinolin-6-yl)methylidene]-1,3-thiazolidine-2,4-dione', 'CHEBI:71955', 'DTXSID00242004', '5-{[4-(pyridin-4-yl)quinolin-6-yl]methylene}-1,3-thiazolidine-2,4-dione']"
60750,"4-amino-1-[(2R,4R,5R)-3,3-difluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one",Zefei,C9H11F2N3O4,263.20,C1=CN(C(=O)N=C1N)C2C(C(C(O2)CO)O)(F)F,"['gemcitabine', '95058-81-4', ""2'-Deoxy-2',2'-difluorocytidine"", ""2',2'-Difluorodeoxycytidine"", 'Gemcitabina', 'dFdC', ""Cytidine, 2'-deoxy-2',2'-difluoro-"", 'Gemcitabine free base', ""2',2'-difluoro-2'-deoxycytidine"", '103882-84-4']"
6253,"4-amino-1-[(2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one",AraC,C9H13N3O5,243.22,C1=CN(C(=O)N=C1N)C2C(C(C(O2)CO)O)O,"['cytarabine', '147-94-4', 'Cytosine arabinoside', 'Aracytidine', 'Arabinocytidine', 'Cytarabinoside', 'Spongocytidine', 'Aracytin', 'Cytosar-U', 'Udicil']"
6252,"4-amino-1-[(2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one;hydrochloride",s5582,C9H14ClN3O5,279.68,C1=CN(C(=O)N=C1N)C2C(C(C(O2)CO)O)O.Cl,"['CYTARABINE HYDROCHLORIDE', 'Cytosine arabinoside hydrochloride', '69-74-9', 'Cytarabine HCl', 'Ara-C hydrochloride', '1-beta-D-Arabinofuranosylcytosine hydrochloride', 'Cytosar hydrochloride', 'Spongocytidine hydrochloride', 'Arabitin hydrochloride', 'Aracytin hydrochloride']"
6029,"1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione",Urd,C9H12N2O6,244.20,C1=CN(C(=O)NC1=O)C2C(C(C(O2)CO)O)O,"['uridine', '58-96-8', 'Uridin', 'Uracil riboside', '1-beta-D-Ribofuranosyluracil', 'beta-Uridine', 'Uracil, 1-beta-D-ribofuranosyl-', 'CHEBI:16704', 'NSC 20256', 'AI3-52690']"
71481097,"(Z)-3-[3-[3,5-bis(trifluoromethyl)phenyl]-1,2,4-triazol-1-yl]-N'-pyrazin-2-ylprop-2-enehydrazide",Xpovio,C17H11F6N7O,443.3,C1=CN=C(C=N1)NNC(=O)C=CN2C=NC(=N2)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F,"['Selinexor', '1393477-72-9', 'KPT-330', 'Xpovio', 'KPT 330', ""(Z)-3-(3-(3,5-Bis(trifluoromethyl)phenyl)-1H-1,2,4-triazol-1-yl)-N'-(pyrazin-2-yl)acrylohydrazide"", 'selinexorum', 'UNII-31TZ62FO8F', '31TZ62FO8F', '2-Propenoic acid, 3-(3-(3,5-bis(trifluoromethyl)phenyl)-1H-1,2,4-triazol-1-yl)-, 2-(2-pyrazinyl)hydrazide, (2Z)-']"
3440,4-chloro-2-(furan-2-ylmethylamino)-5-sulfamoylbenzoic acid,FUN,C12H11ClN2O5S,330.74,C1=COC(=C1)CNC2=CC(=C(C=C2C(=O)O)S(=O)(=O)N)Cl,"['furosemide', '54-31-9', 'Frusemide', 'Lasix', 'Furanthril', 'Furosemid', 'Errolon', 'Fusid', 'Aisemide', 'Beronald']"
60961,"(2R,3R,4S,5R)-2-(6-aminopurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol",Myocol,C10H13N5O4,267.24,C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)CO)O)O)N,"['adenosine', '58-61-7', 'Adenine riboside', 'beta-D-Adenosine', 'Nucleocardyl', 'Adenosin', 'Sandesin', 'Boniton', 'Myocol', 'Adenine nucleoside']"
9444,"4-amino-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,3,5-triazin-2-one",Onureg,C8H12N4O5,244.20,C1=NC(=NC(=O)N1C2C(C(C(O2)CO)O)O)N,"['5-azacytidine', 'Azacitidine', 'Ladakamycin', 'Mylosar', '5-azacitidine', 'Azacitidina', 'Azacitidinum', 'Azacitidinum [INN-Latin]', 'Azacitidina [INN-Spanish]', 'Antibiotic U 18496']"
119182,"(2R,3R,4S,5R)-5-(6-amino-2-chloropurin-9-yl)-4-fluoro-2-(hydroxymethyl)oxolan-3-ol",CAFdA,C10H11ClFN5O3,303.68,C1=NC2=C(N=C(N=C2N1C3C(C(C(O3)CO)O)F)Cl)N,"['Clofarabine', '123318-82-1', 'CAFdA', 'Cl-F-Ara-A', 'clofarabina', '(2R,3R,4S,5R)-5-(6-amino-2-chloropurin-9-yl)-4-fluoro-2-(hydroxymethyl)oxolan-3-ol', 'C1-F-Ara-A', 'clofarabinum', '9H-Purin-6-amine, 2-chloro-9-(2-deoxy-2-fluoro-beta-D-arabinofuranosyl)-', '2-Chloro-9-(2-deoxy-2-fluoro-beta-D-arabinofuranosyl)-9H-purin-6-amine']"
190,7H-purin-6-amine,ADE,C5H5N5,135.13,C1=NC2=NC=NC(=C2N1)N,"['adenine', '73-24-5', '6-Aminopurine', '1H-Purin-6-amine', '7H-Purin-6-amine', 'Vitamin B4', 'Adenin', 'Adeninimine', 'Leuco-4', '6-Amino-1H-purine']"
135401907,"1,5-dihydropyrazolo[3,4-d]pyrimidin-4-one",Gotax,C5H4N4O,136.11,C1=NNC2=C1C(=O)NC=N2,"['allopurinol', '315-30-0', '1H-Pyrazolo[3,4-d]pyrimidin-4-ol', '4-Hydroxypyrazolo[3,4-d]pyrimidine', 'Allopurinolum', '4-HPP', 'Alopurinol', '1H-Pyrazolo(3,4-d)pyrimidin-4-ol', '4-Hydroxypyrazolopyrimidine', '4-Hydroxy-1H-pyrazolo(3,4-d)pyrimidine']"
6256,"1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-(trifluoromethyl)pyrimidine-2,4-dione",TFT,C10H11F3N2O5,296.20,C1C(C(OC1N2C=C(C(=O)NC2=O)C(F)(F)F)CO)O,"['Trifluridine', 'TRIFLUOROTHYMIDINE', '70-00-8', '5-Trifluorothymidine', 'Trifluoromethyldeoxyuridine', 'F3DThd', 'Trifluridina', 'Trifluridinum', 'F3TDR', 'TFDU']"
446727,"5-[(E)-2-bromoethenyl]-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione",BVD,C11H13BrN2O5,333.13,C1C(C(OC1N2C=C(C(=O)NC2=O)C=CBr)CO)O,"['Brivudine', '69304-47-8', ""(E)-5-(2-Bromovinyl)-2'-deoxyuridine"", 'Brivudin', 'Helpin', 'Zostex', 'Brivudine [INN]', 'Brivudina', 'Bromovinyldeoxyuridine', 'Brivudinum']"
5905,"1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-iodopyrimidine-2,4-dione",IDU,C9H11IN2O5,354.10,C1C(C(OC1N2C=C(C(=O)NC2=O)I)CO)O,"['idoxuridine', ""5-Iodo-2'-deoxyuridine"", '5-Iododeoxyuridine', 'Iododeoxyridine', 'Iodoxuridine', 'Joddeoxiuridin', ""2'-Deoxy-5-iodouridine"", 'Herplex', 'IUDR', 'Idoxene']"
451668,"4-amino-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,3,5-triazin-2-one",Dac,C8H12N4O4,228.21,C1C(C(OC1N2C=NC(=NC2=O)N)CO)O,"['Decitabine', ""5-Aza-2'-deoxycytidine"", '2353-33-5', ""2'-Deoxy-5-azacytidine"", '5-Azadeoxycytidine', 'AzadC', '5-Aza-deoxycytidine', '5-AZAdC', '2-deoxyazacytidine', 'Dac']"
46220375,"3-(7-amino-3-oxo-1H-isoindol-2-yl)piperidine-2,6-dione;hydrate",D09813,C26H28N6O7,536.5,C1CC(=O)NC(=O)C1N2CC3=C(C2=O)C=CC=C3N.C1CC(=O)NC(=O)C1N2CC3=C(C2=O)C=CC=C3N.O,"['Lenalidomide hemihydrate', 'Lenalidomide hydrate', 'Lenalidomide hydrate [JAN]', 'UNII-XQT0NAW8WD', 'XQT0NAW8WD', 'Lenalidomide hydrate (JAN)', 'LENALIDOMIDE HEMIHYDRATE [WHO-DD]', '(RS)-3-(4-amino-1-oxoisoindolin-2-yl)piperidine-2,6-dione hemihydrate', '191732-72-6, anhydride', '(3RS)-3-(4-amino-1-oxo-1,3-dihydro-2H-isoindol-2-yl)piperidine-2,6-dione hemihydrate']"
91885558,"N-[(1R,2R,3S)-2-hydroxy-3-phenoxazin-10-ylcyclohexyl]-4-(trifluoromethoxy)benzenesulfonamide",SMAP,C25H23F3N2O5S,520.5,C1CC(C(C(C1)N2C3=CC=CC=C3OC4=CC=CC=C42)O)NS(=O)(=O)C5=CC=C(C=C5)OC(F)(F)F,"['DT-061', '1809427-19-7', 'SMAP', 'DT-061(SMAP)', 'N-[(1R,2R,3S)-2-hydroxy-3-(10H-phenoxazin-10-yl)cyclohexyl]-4-(trifluoromethoxy)benzene-1-sulfonamide', 'N-[(1R,2R,3S)-2-hydroxy-3-phenoxazin-10-ylcyclohexyl]-4-(trifluoromethoxy)benzenesulfonamide', '1809427-18-6', 'SMAP?', 'CHEMBL4450419', 'DT-061 (SMAP)']"
70817911,"2-[4-(1-aminocyclobutyl)phenyl]-3-phenylimidazo[1,2-b]pyridazine-6-carboxamide",s8500,C23H21N5O,383.4,C1CC(C1)(C2=CC=C(C=C2)C3=C(N4C(=N3)C=CC(=N4)C(=O)N)C5=CC=CC=C5)N,"['BAY1125976', 'BAY-1125976', 'Imidazo[1,2-b]pyridazine-6-carboxamide, 2-[4-(1-aminocyclobutyl)phenyl]-3-phenyl-', 'UNII-ZL7A1UM87X', 'BAY 1125976', 'Example 5 [WO2012136776A1]', 'Imidazo(1,2-b)pyridazine-6-carboxamide, 2-(4-(1-aminocyclobutyl)phenyl)-3-phenyl-', 'Example 5 (WO2012136776A1)', 'AKT 1/2 Inhibitor BAY1125976', 'BAY-1125976 [WHO-DD]']"
46188928,"(3S)-N-[5-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-yl]-3-hydroxypyrrolidine-1-carboxamide",Vitrakvi,C21H22F2N6O2,428.4,C1CC(N(C1)C2=NC3=C(C=NN3C=C2)NC(=O)N4CCC(C4)O)C5=C(C=CC(=C5)F)F,"['Larotrectinib', '(S)-N-(5-((R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl)pyrazolo[1,5-a]pyrimidin-3-yl)-3-hydroxypyrrolidine-1-carboxamide', 'LOXO 101', 'ARRY 470', 'PF9462I9HX', '1-Pyrrolidinecarboxamide, N-[5-[(2R)-2-(2,5-difluorophenyl)-1-pyrrolidinyl]pyrazolo[1,5-a]pyrimidin-3-yl]-3-hydroxy-, (3S)-', 'UNII-PF9462I9HX', '(3S)-N-[5-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-yl]-3-hydroxypyrrolidine-1-carboxamide', '1-Pyrrolidinecarboxamide, N-(5-((2R)-2-(2,5-difluorophenyl)-1-pyrrolidinyl)pyrazolo(1,5-a)pyrimidin-3-yl)-3-hydroxy-, (3S)-', 'example 14 (US8865698 B2)']"
67330085,"(3S)-N-[5-[(2R)-2-(2,5-difluorophenyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-yl]-3-hydroxypyrrolidine-1-carboxamide;sulfuric acid",Vitrakvi,C21H24F2N6O6S,526.5,C1CC(N(C1)C2=NC3=C(C=NN3C=C2)NC(=O)N4CCC(C4)O)C5=C(C=CC(=C5)F)F.OS(=O)(=O)O,"['Larotrectinib sulfate', '1223405-08-0', 'LOXO-101 sulfate', 'ARRY-470 sulfate', 'RDF76R62ID', 'LOXO 101 sulfate', 'UNII-RDF76R62ID', '1-Pyrrolidinecarboxamide, N-[5-[(2R)-2-(2,5-difluorophenyl)-1-pyrrolidinyl]pyrazolo[1,5-a]pyrimidin-3-yl]-3-hydroxy-, (3S)-, sulfate (1:1)', '1-Pyrrolidinecarboxamide, N-(5-((2R)-2-(2,5-difluorophenyl)-1-pyrrolidinyl)pyrazolo(1,5-a)pyrimidin-3-yl)-3-hydroxy-, (3S)-, sulfate (1:1)', '(3S)-N-(5-((2R)-2-(2,5-DIFLUOROPHENYL)PYRROLIDIN-1-YL)PYRAZOLO(1,5-A)PYRIMIDIN-3-YL)-3-HYDROXYPYRROLIDINE-1-CARBOXAMIDE SULFATE (1:1)']"
23725625,4-[[3-[4-(cyclopropanecarbonyl)piperazine-1-carbonyl]-4-fluorophenyl]methyl]-2H-phthalazin-1-one,Olaparib,C24H23FN4O3,434.5,C1CC1C(=O)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)CC4=NNC(=O)C5=CC=CC=C54)F,"['Olaparib', '763113-22-0', 'AZD2281', 'Lynparza', 'KU-0059436', 'AZD-2281', 'AZD 2281', 'OLAPARIB cpd', 'KU-59436', 'UNII-WOH1JD9AR8']"
49831257,"N-[5-[4-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide",Jyseleca,C21H23N5O3S,425.5,C1CC1C(=O)NC2=NN3C(=N2)C=CC=C3C4=CC=C(C=C4)CN5CCS(=O)(=O)CC5,"['Filgotinib', '1206101-20-3', 'GLPG0634', '1206161-97-8', 'GLPG-0634', 'N-(5-(4-((1,1-dioxidothiomorpholino)methyl)phenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropanecarboxamide', 'Filgotinib (GLPG0634)', 'N-[5-[4-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide', 'N-[5-[4-[(1,1-Dioxido-4-thiomorpholinyl)methyl]phenyl][1,2,4]triazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide', 'Filgotinib(GLPG0634)']"
137628686,"N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-4-[6-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidin-3-yl]thiophene-2-carboxamide",s8793,C22H16F4N4OS,460.4,C1CC1C(C(F)(F)F)NC(=O)C2=CC(=CS2)C3=C4N=CC(=CN4N=C3)C5=CC=C(C=C5)F,"['ULK-101', '2443816-45-1', '(S)-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-4-(6-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidin-3-yl)thiophene-2-carboxamide', 'N-[(1S)-1-Cyclopropyl-2,2,2-trifluoroethyl]-4-[6-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidin-3-yl]thiophene-2-carboxamide', 'CHEMBL4744680', 'SCHEMBL25395801', 'EX-A4693', 'NSC828446', 's8793', 'AKOS037649333']"
9887053,"[(1R,2R)-2-azanidylcyclohexyl]azanide;oxalic acid;platinum(2+)",CS-0992,C8H14N2O4Pt,397.29,C1CCC(C(C1)[NH-])[NH-].C(=O)(C(=O)O)O.[Pt+2],"['oxaliplatin', 'DTXSID0036760', 'Oxalato(trans-l-1,2-cyclohexanediamine)platinum(II)', 'cis-oxalato-trans-l-1,2-diaminocyclohexaneplatinum(II)', 'CAS-61825-94-3', 'Oxaliplatin [USAN:INN:BAN]', 'NCGC00167798-01', 'Oxaliplatin (Standard)', 'SCHEMBL19511', 'HMS3269F19']"
2754,"6-[4-(1-cyclohexyltetrazol-5-yl)butoxy]-3,4-dihydro-1H-quinolin-2-one",Pletal,C20H27N5O2,369.5,C1CCC(CC1)N2C(=NN=N2)CCCCOC3=CC4=C(C=C3)NC(=O)CC4,"['cilostazol', '73963-72-1', 'Cilostazole', 'Pletaal', 'Cilostazolum', 'OPC-21', 'Cilostazolum [INN-Latin]', 'OPC 21', 'CHEBI:31401', '6-(4-(1-Cyclohexyl-1H-tetrazol-5-yl)butoxy)-3,4-dihydro-2(1H)-quinolinone']"
10029385,"3-[6-fluoro-10-(piperidine-1-carbonyl)-1,10-diazatricyclo[6.4.1.04,13]trideca-2,4,6,8(13)-tetraen-3-yl]-4-imidazo[1,2-a]pyridin-3-ylpyrrole-2,5-dione",s7063,C28H25FN6O3,512.5,C1CCN(CC1)C(=O)N2CCN3C=C(C4=CC(=CC(=C43)C2)F)C5=C(C(=O)NC5=O)C6=CN=C7N6C=CC=C7,"['LY2090314', 'LY-2090314', '3-(9-Fluoro-2-(piperidine-1-carbonyl)-1,2,3,4-tetrahydro-[1,4]diazepino[6,7,1-hi]indol-7-yl)-4-(imidazo[1,2-a]pyridin-3-yl)-1H-pyrrole-2,5-dione', 'UNII-822M3GYM67', 'CHEBI:167661', 'DTXSID90209085', '1H-PYRROLE-2,5-DIONE, 3-(9-FLUORO-1,2,3,4-TETRAHYDRO-2-(1-PIPERIDINYLCARBONYL)PYRROLO(3,2,1-JK)(1,4)BENZODIAZEPIN-7-YL)-4-IMIDAZO(1,2-A)PYRIDIN-3-YL-', '3-[9-fluoro-1,2,3,4-tetrahydro-2-(1-piperidinylcarbonyl)pyrrolo[3,2,1-jk][1,4]benzodiazepin-7-yl]-4-imidazo[1,2-a]pyridin-3-yl-1H-pyrrole-2,5-dione', '3-[9-fluoro-2-(piperidin-1-ylcarbonyl)-1,2,3,4-tetrahydro[1,4]diazepino[6,7,1-hi]indol-7-yl]-4-(imidazo[1,2-a]pyridin-3-yl)-1H-pyrrole-2,5-dione', 'PYRROLO(3,2,1-JK)(1,4)BENZODIAZEPINE, 7-(2,5-DIHYDRO-4-IMIDAZO(1,2-A)PYRIDIN-3-YL-2,5-DIOXO-1H-PYRROL-3-YL)-9-FLUORO-1,2,3,4-TETRAHYDRO-2-(1-PIPERIDINYLCARBONYL)-']"
16222096,"[3,4-difluoro-2-(2-fluoro-4-iodoanilino)phenyl]-[3-hydroxy-3-[(2S)-piperidin-2-yl]azetidin-1-yl]methanone",EUI,C21H21F3IN3O2,531.3,C1CCNC(C1)C2(CN(C2)C(=O)C3=C(C(=C(C=C3)F)F)NC4=C(C=C(C=C4)I)F)O,"['Cobimetinib', '934660-93-2', 'XL518', 'GDC-0973', 'Xl-518', 'GDC 0973', 'RG7420', 'XL 518', 'RG 7420', 'Cobimetinib Butyrate']"
72165228,N-[4-[chloro(difluoro)methoxy]phenyl]-6-[(3R)-3-hydroxypyrrolidin-1-yl]-5-(1H-pyrazol-5-yl)pyridine-3-carboxamide,AY7,C20H18ClF2N5O3,449.8,C1CN(CC1O)C2=C(C=C(C=N2)C(=O)NC3=CC=C(C=C3)OC(F)(F)Cl)C4=CC=NN4,"['asciminib', '1492952-76-7', 'ABL001-NX', 'NVP-ABL001', 'Example 9', 'L1F3R18W77', 'UNII-L1F3R18W77', '3-Pyridinecarboxamide, N-(4-(chlorodifluoromethoxy)phenyl)-6-((3R)-3-hydroxy-1-pyrrolidinyl)-5-(1H-pyrazol-3-yl)-', '3-Pyridinecarboxamide, N-[4-(chlorodifluoromethoxy)phenyl]-6-[(3R)-3-hydroxy-1-pyrrolidinyl]-5-(1H-pyrazol-3-yl)-', 'N-[4-(chlorodifluoromethoxy)phenyl]-6-[(3r)-3-hydroxypyrrolidin-1-yl]-5-(1h-pyrazol-3-yl)pyridine-3-carboxamide']"
25227436,"4-amino-N-[(1S)-1-(4-chlorophenyl)-3-hydroxypropyl]-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide",Truqap,C21H25ClN6O2,428.9,C1CN(CCC1(C(=O)NC(CCO)C2=CC=C(C=C2)Cl)N)C3=NC=NC4=C3C=CN4,"['capivasertib', '1143532-39-1', 'AZD5363', 'AZD-5363', 'AZD 5363', 'Truqap', '4-Amino-N-[(1s)-1-(4-Chlorophenyl)-3-Hydroxypropyl]-1-(7h-Pyrrolo[2,3-D]pyrimidin-4-Yl)piperidine-4-Carboxamide', '4-Piperidinecarboxamide, 4-amino-N-[(1S)-1-(4-chlorophenyl)-3-hydroxypropyl]-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-', 'WFR23M21IE', 'cc-638']"
33630,"1-[4,4-bis(4-fluorophenyl)butyl]-4-[4-chloro-3-(trifluoromethyl)phenyl]piperidin-4-ol",Semap,C28H27ClF5NO,524.0,C1CN(CCC1(C2=CC(=C(C=C2)Cl)C(F)(F)F)O)CCCC(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F,"['PENFLURIDOL', '26864-56-2', 'Semap', 'Penfluridolum', 'McN-JR-16,341', 'TLP-607', 'Micefal', 'Penfluridolum [INN-Latin]', 'R-16341', 'R 16341']"
148195,"4-[2-[4-[(2R)-6,15-dibromo-13-chloro-4-azatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-yl]piperidin-1-yl]-2-oxoethyl]piperidine-1-carboxamide",Sarasar,C27H31Br2ClN4O2,638.8,C1CN(CCC1CC(=O)N2CCC(CC2)C3C4=C(CCC5=C3N=CC(=C5)Br)C=C(C=C4Br)Cl)C(=O)N,"['Lonafarnib', '193275-84-2', 'Sarasar', 'Sch-66336', 'Zokinvy', 'lonafarnibum', 'UNII-IOW153004F', 'IOW153004F', '(+)-4-(2-(4-(11R)-3,10-Dibromo-8-chloro-6,11-dihydro-5H-benzo(5,6)cyclohepta(1,2-b)pyridin-11-yl)-piperidin-1-yl))-2-oxoethyl)-piperidine-1-carboxamide', 'CHEBI:47097']"
16362,"3-[1-[4,4-bis(4-fluorophenyl)butyl]piperidin-4-yl]-1H-benzimidazol-2-one",Orap,C28H29F2N3O,461.5,C1CN(CCC1N2C3=CC=CC=C3NC2=O)CCCC(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F,"['pimozide', '2062-78-4', 'Opiran', 'Pimozidum', 'pimozida', 'McN-JR-6238', 'Pimozidum [INN-Latin]', 'Primozida', 'R 6238', 'Primozida [INN-Spanish]']"
20179,"N-(2,6-dichlorophenyl)-4,5-dihydro-1H-imidazol-2-amine;hydrochloride",Kapvay,C9H10Cl3N3,266.6,C1CN=C(N1)NC2=C(C=CC=C2Cl)Cl.Cl,"['CLONIDINE HYDROCHLORIDE', '4205-91-8', 'Clonidine HCl', '2-(2,6-Dichloroanilino)-2-imidazoline hydrochloride', 'Kapvay', 'Duraclon', 'Dispaclonidin', 'Atensina', 'Capresin', 'Caprysin']"
2435,"5-bromo-N-(4,5-dihydro-1H-imidazol-2-yl)quinoxalin-6-amine",Brimodine,C11H10BrN5,292.13,C1CN=C(N1)NC2=C(C3=NC=CN=C3C=C2)Br,"['brimonidine', '59803-98-4', 'Bromoxidine', '5-bromo-N-(4,5-dihydro-1H-imidazol-2-yl)quinoxalin-6-amine', 'brimonidina', 'brimonidinum', '5-Bromo-6-(2-imidazolin-2-ylamino)quinoxaline', '5-bromo-6-(imidazolin-2-ylamino)quinoxaline', '6-Quinoxalinamine, 5-bromo-N-(4,5-dihydro-1H-imidazol-2-yl)-', 'E6GNX3HHTE']"
11338033,"4-[(2,6-dichlorobenzoyl)amino]-N-piperidin-4-yl-1H-pyrazole-5-carboxamide",LZE,C16H17Cl2N5O2,382.2,C1CNCCC1NC(=O)C2=C(C=NN2)NC(=O)C3=C(C=CC=C3Cl)Cl,"['AT7519', '844442-38-2', 'AT-7519', 'AT 7519', 'Cdki at7519', '4-(2,6-Dichloro-benzoylamino)-1H-pyrazole-3-carboxylic acid piperidin-4-ylamide', 'X1BF92PW9T', '1H-Pyrazole-3-carboxamide, 4-((2,6-dichlorobenzoyl)amino)-n-4-piperidinyl', '4-(2,6-Dichlorobenzoylamino)-1H-pyrazole-3-carboxylic acid N-(piperidin-4-yl)amide', 'DTXSID30233420']"
3064778,"5-(1,4-diazepan-1-ylsulfonyl)-2H-isoquinolin-1-one",HYDROXYFASUDIL,C14H17N3O3S,307.37,C1CNCCN(C1)S(=O)(=O)C2=CC=CC3=C2C=CNC3=O,"['HYDROXYFASUDIL', 'Hydroxy-Fasudil', 'HA-1100', '5-((1,4-Diazepan-1-yl)sulfonyl)isoquinolin-1(2H)-one', 'EYH4AU7P63', '1-[(1,2-DIHYDRO-1-OXO-5-ISOQUINOLINYL)SULFONYL]HEXAHYDRO-1H-1,4-DIAZEPINE', '5-(1,4-DIAZEPAN-1-YLSULFONYL)-1(2H)-ISOQUINOLINONE', '1(2H)-ISOQUINOLINONE, 5-((HEXAHYDRO-1H-1,4-DIAZEPIN-1-YL)SULFONYL)-', '1-((1,2-DIHYDRO-1-OXO-5-ISOQUINOLINYL)SULFONYL)HEXAHYDRO-1H-1,4-DIAZEPINE', '5-[(1,4-Diazepan-1-yl)sulfonyl]isoquinolin-1(2H)-one']"
2747117,"4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(5-nitro-1,3-thiazol-2-yl)sulfanyl]-1H-1,2,4-triazol-5-one",s8201,C13H9N5O5S2,379.4,C1COC2=C(O1)C=CC(=C2)N3C(=O)NN=C3SC4=NC=C(S4)[N+](=O)[O-],"['BI-78D3', '883065-90-5', 'BI 78D3', '4-(2,3-Dihydrobenzo[b][1,4]dioxin-6-yl)-3-((5-nitrothiazol-2-yl)thio)-1H-1,2,4-triazol-5(4H)-one', 'CHEMBL508280', '4-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2,4-dihydro-5-[(5-nitro-2-thiazolyl)thio]-3H-1,2,4-triazol-3-one', '4-(2,3-Dihydrobenzo[b][1,4]dioxin-6-yl)-3-((5-nitro-thiazol-2-yl)thio)-1H-1,2,4-triazol-5(4H)-one', '4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(5-nitro-1,3-thiazol-2-yl)sulfanyl]-1H-1,2,4-triazol-5-one', '4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(5-nitro-2-thiazolyl)thio]-1H-1,2,4-triazol-5-one', 'MFCD01313575']"
71766360,"4-[6-[4-(morpholine-4-carbonyl)phenyl]imidazo[1,2-a]pyridin-3-yl]benzonitrile",Tinodasertib,C25H20N4O2,408.5,C1COCCN1C(=O)C2=CC=C(C=C2)C3=CN4C(=NC=C4C5=CC=C(C=C5)C#N)C=C3,"['ETC-206', '1464151-33-4', 'Tinodasertib', '4-(6-(4-(morpholine-4-carbonyl)phenyl)imidazo[1,2-a]pyridin-3-yl)benzonitrile', 'AUM001', 'AUM-001', 'ETC206', 'MND3WX2R7I', 'ETC1907206', 'ETC-206 (AUM 001)']"
118704762,"2,6-difluoro-4-[4-(4-morpholin-4-ylphenyl)pyridin-3-yl]phenol",A1LU8,C21H18F2N2O2,368.4,C1COCCN1C2=CC=C(C=C2)C3=C(C=NC=C3)C4=CC(=C(C(=C4)F)O)F,"['LJI308', '1627709-94-7', '2,6-Difluoro-4-(4-(4-morpholinophenyl)pyridin-3-yl)phenol', 'CHEMBL3604794', '2,6-difluoro-4-[4-(4-morpholin-4-ylphenyl)pyridin-3-yl]phenol', '2,6-difluoro-4-{4-[4-(morpholin-4-yl)phenyl]pyridin-3-yl}phenol', 'A1LU8', 'NVP-LJI308', 'SCHEMBL22374661', 'LJI-308']"
58507717,"5-(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)-4-(trifluoromethyl)pyridin-2-amine",Bimiralisib,C17H20F3N7O2,411.4,C1COCCN1C2=NC(=NC(=N2)C3=CN=C(C=C3C(F)(F)F)N)N4CCOCC4,"['Bimiralisib', '1225037-39-7', 'PQR309', 'PI3K-IN-2', 'PQR-309', '5-(4,6-dimorpholino-1,3,5-triazin-2-yl)-4-(trifluoromethyl)pyridin-2-amine', 'NCB5', 'Bimiralisib [INN]', 'Bimiralisib [USAN]', 'Bimiralisib [WHO-DD]']"
10195250,"2-(1,3-benzothiazol-2-yl)-2-[2-[[4-(morpholin-4-ylmethyl)phenyl]methoxy]pyrimidin-4-yl]acetonitrile",Bentamapimod,C25H23N5O2S,457.5,C1COCCN1CC2=CC=C(C=C2)COC3=NC=CC(=N3)C(C#N)C4=NC5=CC=CC=C5S4,"['Bentamapimod', '848344-36-5', 'AS 602801', 'AS-602801', 'AS602801', 'Bentamapimod [INN]', 'PGL5001', 'UNII-TT3L4B4U0N', 'PGL-5001', 'TT3L4B4U0N']"
6112,5-[(3R)-dithiolan-3-yl]pentanoic acid,Lipoec,C8H14O2S2,206.3,C1CSSC1CCCCC(=O)O,"['lipoic acid', '1200-22-2', '(R)-lipoic acid', '(R)-5-(1,2-Dithiolan-3-yl)pentanoic acid', '(R)-(+)-1,2-Dithiolane-3-pentanoic acid', '(R)-alpha-Lipoic acid', '1,2-Dithiolane-3-pentanoic acid, (3R)-', '(+)-alpha-Lipoic acid', 'Thioctic acid d-form', 'D-Thioctic acid']"
6437836,"(2E,4E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,4,6,10,14-pentaenoic acid",TMHDP,C20H30O2,302.5,CC(=CCCC(=CCCC(=CC=CC(=CC(=O)O)C)C)C)C,"['Peretinoin', 'Acyclic retinoid', 'Peretinoin [INN]', 'CCRIS 9040', '3,7,11,15-Tetramethyl-2,4,6,10,14-hexadecapentaenoic acid', 'UNII-11ALM7A4RV', 'Peretinoin (JAN)', 'PERETINOIN [JAN]', 'PERETINOIN [MART.]', 'PERETINOIN [WHO-DD]']"
5823908,"(2E)-2-[(4-acetylphenyl)hydrazinylidene]-2-(3,3-dimethyl-4H-isoquinolin-1-yl)acetamide",IQ1,C21H22N4O2,362.4,CC(=O)C1=CC=C(C=C1)NN=C(C2=NC(CC3=CC=CC=C32)(C)C)C(=O)N,"['IQ-1', '331001-62-8', 'IQ 1', 'LL3UF6K9AR', 'UNII-LL3UF6K9AR', '2-(4-Acetyl-phenylazo)-2-(3,3-dimethyl-3,4-dihydro-2H-isoquinolin-1-ylidene)-acetamide', '2-((4-Acetylphenyl)hydrazinylidene)-2-(3,3-dimethyl-4H-isoquinolin-1-yl)acetamide', 'Acetamide, 2-(2-(4-acetylphenyl)diazenyl)-2-(3,4-dihydro-3,3-dimethyl-1(2H)-isoquinolinylidene)-', 'IQ1', '2-(2-(4-Acetylphenyl)diazenyl)-2-(3,4-dihydro-3,3-dimethyl-1(2H)-isoquinolinylidene)acetamide']"
1989,1-(4-acetylphenyl)sulfonyl-3-cyclohexylurea,Dimelor,C15H20N2O4S,324.4,CC(=O)C1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2CCCCC2,"['acetohexamide', '968-81-0', 'Acetohexamid', 'Dimelor', 'Hypoglicil', 'Metaglucina', 'Tsiklamid', 'Minoral', 'Ordimel', 'Acetohexamida']"
4740,"3,7-dimethyl-1-(5-oxohexyl)purine-2,6-dione",PNX,C13H18N4O3,278.31,CC(=O)CCCCN1C(=O)C2=C(N=CN2C)N(C1=O)C,"['pentoxifylline', '6493-05-6', 'Oxpentifylline', 'Pentoxifyllin', 'Pentoxyphylline', 'Pentoxiphyllium', 'Vazofirin', '3,7-Dimethyl-1-(5-oxohexyl)xanthine', 'Dimethyloxohexylxanthine', 'Pentoxiphyllin']"
86295191,(2R)-2-[[(2R)-2-acetamido-3-(4-hydroxyphenyl)propanoyl]amino]-N-[(2R)-1-amino-1-oxo-3-phenylpropan-2-yl]-5-(diaminomethylideneamino)pentanamide,DTP3,C26H35N7O5,525.6,CC(=O)NC(CC1=CC=C(C=C1)O)C(=O)NC(CCCN=C(N)N)C(=O)NC(CC2=CC=CC=C2)C(=O)N,"['DTP3', '1809784-29-9', 'DTP-3', '(R)-2-((R)-2-Acetamido-3-(4-hydroxyphenyl)propanamido)-N-((R)-1-amino-1-oxo-3-phenylpropan-2-yl)-5-guanidinopentanamide', 'D-Phenylalaninamide, N-acetyl-D-tyrosyl-D-arginyl-', '7UXW0T8LS8', '(2R)-2-[[(2R)-2-acetamido-3-(4-hydroxyphenyl)propanoyl]amino]-N-[(2R)-1-amino-1-oxo-3-phenylpropan-2-yl]-5-(diaminomethylideneamino)pentanamide', '(2R)-5-carbamimidamido-N-[(1R)-1-carbamoyl-2-phenylethyl]-2-[(2R)-2-acetamido-3-(4-hydroxyphenyl)propanamido]pentanamide', 'DTP3 FREE PEPTIDE', 'UNII-7UXW0T8LS8']"
1986,"N-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)acetamide",Didoc,C4H6N4O3S2,222.3,CC(=O)NC1=NN=C(S1)S(=O)(=O)N,"['acetazolamide', '59-66-5', 'Acetamox', 'Nephramide', 'Acetazolamid', 'Phonurit', 'Donmox', 'N-(5-Sulfamoyl-1,3,4-thiadiazol-2-yl)acetamide', 'Didoc', 'Diuriwas']"
72205932,"acetic acid;[(3S,6S,9S,12R,15S,18S,20R)-9-(4-aminobutyl)-3-benzyl-12-(1H-indol-3-ylmethyl)-2,5,8,11,14,17-hexaoxo-15-phenyl-6-[(4-phenylmethoxyphenyl)methyl]-1,4,7,10,13,16-hexazabicyclo[16.3.0]henicosan-20-yl] N-(2-aminoethyl)carbamate",G17186,C60H70N10O11,1107.3,CC(=O)O.C1C(CN2C1C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C2=O)CC3=CC=CC=C3)CC4=CC=C(C=C4)OCC5=CC=CC=C5)CCCCN)CC6=CNC7=CC=CC=C76)C8=CC=CC=C8)OC(=O)NCCN,"['Pasireotide acetate', '396091-76-2', 'Pasireotide acetate salt [MI]', 'UNII-662X0VFR9L', '662X0VFR9L', 'Cyclo((2S)-2-phenylglycyl-D-tryptophyl-L-lysyl-O-(phenylmethyl)-L-tyrosyl-L-phenylalanyl-(4R)-4-((((2-aminoethyl)amino)carbonyl)oxy)-L-prolyl), monoacetate', 'Pasireotide acetate salt', 'Pasireotide (acetate)', 'acetic acid compound with (E)-(1Z,3S,4Z,6R,7Z,9S,10Z,12S,13Z,15S,19R,20aS)-6-((1H-indol-3-yl)methyl)-9-(4-aminobutyl)-15-benzyl-12-(4-(benzyloxy)benzyl)-1,4,7,10,13-pentahydroxy-16-oxo-3-phenyl-3,6,9,12,15,16,18,19,20,20a-decahydropyrrolo[1,2-a][1,4,7,10,', 'acetic acid;[(3S,6S,9S,12R,15S,18S,20R)-9-(4-aminobutyl)-3-benzyl-12-(1H-indol-3-ylmethyl)-2,5,8,11,14,17-hexaoxo-15-phenyl-6-[(4-phenylmethoxyphenyl)methyl]-1,4,7,10,13,16-hexazabicyclo[16.3.0]henicosan-20-yl] N-(2-aminoethyl)carbamate']"
9562059,acetic acid;(1E)-2-[6-[[amino-[(E)-[amino-(4-chloroanilino)methylidene]amino]methylidene]amino]hexyl]-1-[amino-(4-chloroanilino)methylidene]guanidine,Serdaen,C26H38Cl2N10O4,625.5,CC(=O)O.CC(=O)O.C1=CC(=CC=C1NC(=NC(=NCCCCCCN=C(N)N=C(N)NC2=CC=C(C=C2)Cl)N)N)Cl,"['Chlorhexidine diacetate', 'Chlorhexidine acetate', '56-95-1', 'Hibitane diacetate', 'Chlorohexidine diacetate', 'Caswell No. 481E', '10,040 Diacetate', 'Chlorhexidine di(acetate)', 'Chlorhexidine acetate (VAN)', 'chlorhexidine diacetate salt']"
2244,2-acetyloxybenzoic acid,ASA,C9H8O4,180.16,CC(=O)OC1=CC=CC=C1C(=O)O,"['aspirin', 'ACETYLSALICYLIC ACID', '50-78-2', '2-(Acetyloxy)benzoic acid', 'Acetosal', 'Acenterine', 'Acetophen', 'Acetosalin', 'Aspirdrops', 'Salcetogen']"
9821849,"[(3S,8R,9S,10R,13S,14S)-10,13-dimethyl-17-pyridin-3-yl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate",Yonsa,C26H33NO2,391.5,CC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)CC=C4C5=CN=CC=C5)C)C,"['Abiraterone acetate', '154229-18-2', 'Yonsa', 'UNII-EM5OCB9YJ6', 'EM5OCB9YJ6', 'NSC-748121', 'NSC-749227', 'DTXSID3049043', 'CHEBI:68639', 'JNJ-212082']"
23663985,"sodium;2-[[2-[[4-(2,2-dimethylpropanoyloxy)phenyl]sulfonylamino]benzoyl]amino]acetate;tetrahydrate",Elaspol,C20H29N2NaO11S,528.5,CC(C)(C)C(=O)OC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)NCC(=O)[O-].O.O.O.O.[Na+],"['Sivelestat sodium tetrahydrate', '201677-61-4', 'sivelestat sodium hydrate', 'Elaspol', 'ONO-5046.Na', 'LY544349 Sodium Hydrate', 'Sivelestat sodium [USAN]', 'Elaspol (TN)', 'EI-546', 'Sivelestat sodium (USAN)']"
158550,"methyl N-[(2S)-1-[2-[(2S,3S)-2-hydroxy-3-[[(2S)-2-(methoxycarbonylamino)-3,3-dimethylbutanoyl]amino]-4-phenylbutyl]-2-[(4-pyridin-2-ylphenyl)methyl]hydrazinyl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate;sulfuric acid",Atazor,C38H54N6O11S,802.9,CC(C)(C)C(C(=O)NC(CC1=CC=CC=C1)C(CN(CC2=CC=C(C=C2)C3=CC=CC=N3)NC(=O)C(C(C)(C)C)NC(=O)OC)O)NC(=O)OC.OS(=O)(=O)O,"['Atazanavir sulfate', '229975-97-7', 'Atazor', 'Atazanavir so4', 'UNII-4MT4VIE29P', '4MT4VIE29P', 'NSC-742546', 'CHEBI:31243', 'DTXSID401017206', 'NSC 742546']"
5405,1-(4-tert-butylphenyl)-4-[4-[hydroxy(diphenyl)methyl]piperidin-1-yl]butan-1-ol,Terfex,C32H41NO2,471.7,CC(C)(C)C1=CC=C(C=C1)C(CCCN2CCC(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O)O,"['terfenadine', '50679-08-8', 'Seldane', 'Ternadin', 'Triludan', 'Teldane', 'Terfenadina', 'RMI 9918', 'Terfenadinum', 'Terfex']"
185462,4-tert-butyl-N-[6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-yl]benzenesulfonamide;hydrate,s3051,C27H31N5O7S,569.6,CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NC(=N2)C3=NC=CC=N3)OCCO)OC4=CC=CC=C4OC.O,"['4-tert-butyl-N-(6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)-2-(pyrimidin-2-yl)pyrimidin-4-yl)benzene-1-sulfonamide Monohydrate', '4-tert-butyl-N-[6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)-2-(pyrimidin-2-yl)pyrimidin-4-yl]benzene-1-sulfonamide monohydrate', '691-652-0', 'Bosentan hydrate', '157212-55-0', 'bosentan monohydrate', ""4-(tert-Butyl)-N-(6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)-[2,2'-bipyrimidin]-4-yl)benzenesulfonamide hydrate"", 'Bosentan (hydrate)', 'Bosentan [USAN]', '4-tert-butyl-N-[6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-yl]benzenesulfonamide;hydrate']"
44462760,"N-[3-[5-(2-aminopyrimidin-4-yl)-2-tert-butyl-1,3-thiazol-4-yl]-2-fluorophenyl]-2,6-difluorobenzenesulfonamide",Tafinlar,C23H20F3N5O2S2,519.6,CC(C)(C)C1=NC(=C(S1)C2=NC(=NC=C2)N)C3=C(C(=CC=C3)NS(=O)(=O)C4=C(C=CC=C4F)F)F,"['Dabrafenib', '1195765-45-7', 'GSK2118436A', 'UNII-QGP4HA4G1B', 'QGP4HA4G1B', 'GSK-2118436A', 'CHEBI:75045', 'Benzenesulfonamide, N-[3-[5-(2-amino-4-pyrimidinyl)-2-(1,1-dimethylethyl)-4-thiazolyl]-2-fluorophenyl]-2,6-difluoro-', 'DTXSID20152499', 'GSK 2118436A']"
11570805,"5-[2-tert-butyl-4-(4-fluorophenyl)-1H-imidazol-5-yl]-3-(2,2-dimethylpropyl)imidazo[4,5-b]pyridin-2-amine;methanesulfonic acid",ZZ-84,C26H37FN6O6S2,612.7,CC(C)(C)CN1C2=C(C=CC(=N2)C3=C(N=C(N3)C(C)(C)C)C4=CC=C(C=C4)F)N=C1N.CS(=O)(=O)O.CS(=O)(=O)O,"['LY2228820', 'Ralimetinib Mesylate', 'Ralimetinib dimesylate', 'LY2228820 diMesylate', 'Ralimetinib mesilate', 'Ralimetinib mesylate [USAN]', 'UNII-QUW7B71FO9', 'QUW7B71FO9', 'ZZ-84', 'LSN2322600']"
441243,"(2S)-N-[(2S,3R)-4-[(3S,4aS,8aS)-3-(tert-butylcarbamoyl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-3-hydroxy-1-phenylbutan-2-yl]-2-(quinoline-2-carbonylamino)butanediamide",ROC,C38H50N6O5,670.8,CC(C)(C)NC(=O)C1CC2CCCCC2CN1CC(C(CC3=CC=CC=C3)NC(=O)C(CC(=O)N)NC(=O)C4=NC5=CC=CC=C5C=C4)O,"['SAQUINAVIR', '127779-20-8', 'Fortovase', 'Saquinavirum', 'CHEBI:63621', 'UNII-L3JE09KZ2F', 'L3JE09KZ2F', 'Ro 31-8959/000', 'Sch 52852', 'HSDB 7161']"
9853654,(3S)-4-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-3-[[(2S)-2-[[(2S)-3-(1H-indol-3-yl)-2-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoylamino]propanoyl]amino]-4-methylsulfanylbutanoyl]amino]-4-oxobutanoic acid,PETAVLON,C37H49N7O9S,767.9,CC(C)(C)OC(=O)NCCC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)NC(CCSC)C(=O)NC(CC(=O)O)C(=O)NC(CC3=CC=CC=C3)C(=O)N,"['pentagastrin', '5534-95-2', 'Pentagastrina', 'Pentagastrine', 'Gastrodiagnost', 'Pentagastrinum', 'Petogasrin', 'ICI-50123', 'AY 6608', 'AY-6608']"
2187,"2-[3-(2-cyanopropan-2-yl)-5-(1,2,4-triazol-1-ylmethyl)phenyl]-2-methylpropanenitrile",Asiolex,C17H19N5,293.4,CC(C)(C#N)C1=CC(=CC(=C1)CN2C=NC=N2)C(C)(C)C#N,"['anastrozole', '120511-73-1', 'anastrazole', 'Anastrozol', 'Asiolex', 'ICI-D1033', 'HSDB 7462', 'ICI-D 1033', 'UNII-2Z07MYW1AZ', '2Z07MYW1AZ']"
276389,"1-O-[(2S,3S,6R)-4-methoxy-16,18-dioxa-10-azapentacyclo[11.7.0.02,6.06,10.015,19]icosa-1(20),4,13,15(19)-tetraen-3-yl] 4-O-methyl (2R)-2-hydroxy-2-(3-hydroxy-3-methylbutyl)butanedioate",Harringtonin,C28H37NO9,531.6,CC(C)(CCC(CC(=O)OC)(C(=O)OC1C2C3=CC4=C(C=C3CCN5C2(CCC5)C=C1OC)OCO4)O)O,"['harringtonine', 'Harringtonin', '26833-85-2', ""2'R-Harringtonine"", 'NSC-124147', 'NSC 124147', 'Cephalotaxine, 4-methyl (2R)-2-hydroxy-2-(3-hydroxy-3-methylbutyl)butanedioate (ester)', 'HARRINGTONINE [WHO-DD]', '088662H40F', '1-O-[(2S,3S,6R)-4-methoxy-16,18-dioxa-10-azapentacyclo[11.7.0.02,6.06,10.015,19]icosa-1(20),4,13,15(19)-tetraen-3-yl] 4-O-methyl (2R)-2-hydroxy-2-(3-hydroxy-3-methylbutyl)butanedioate']"
285033,"1-O-[(2S,3S,6R)-4-methoxy-16,18-dioxa-10-azapentacyclo[11.7.0.02,6.06,10.015,19]icosa-1(20),4,13,15(19)-tetraen-3-yl] 4-O-methyl (2R)-2-hydroxy-2-(4-hydroxy-4-methylpentyl)butanedioate",HHT,C29H39NO9,545.6,CC(C)(CCCC(CC(=O)OC)(C(=O)OC1C2C3=CC4=C(C=C3CCN5C2(CCC5)C=C1OC)OCO4)O)O,"['homoharringtonine', 'Omacetaxine mepesuccinate', '26833-87-4', 'Myelostat', 'CGX-635', 'Omapro', 'Homoharringtonin', '(-)-homoharringtonine', 'NSC-141633', 'NSC 141633']"
3397,2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanamide,NFBA,C11H11F3N2O3,276.21,CC(C)C(=O)NC1=CC(=C(C=C1)[N+](=O)[O-])C(F)(F)F,"['flutamide', '13311-84-7', 'Niftolide', 'Niftholide', 'niftolid', 'NFBA', '2-Methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanamide', 'Flutamida', 'Cebatrol, veterinary', 'Flutamidum']"
451417,(3S)-3-[[(2S)-6-amino-2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]hexanoyl]amino]-4-[[(2S)-1-[[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]amino]-4-oxobutanoic acid,RKDVY,C30H49N9O9,679.8,CC(C)C(C(=O)NC(CC1=CC=C(C=C1)O)C(=O)O)NC(=O)C(CC(=O)O)NC(=O)C(CCCCN)NC(=O)C(CCCN=C(N)N)N,"['THYMOPENTIN', '69558-55-0', 'Timunox', 'Arg-Lys-Asp-Val-Tyr', 'Sintomodulina', 'Thymopentine', 'Timopentina', 'Thymopoietin 32-36', 'IMMUNOX', 'Hg-thymopentin']"
5493444,"(2S,4S,5S,7S)-5-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-hydroxy-7-[[4-methoxy-3-(3-methoxypropoxy)phenyl]methyl]-8-methyl-2-propan-2-ylnonanamide",Rasilez,C30H53N3O6,551.8,CC(C)C(CC1=CC(=C(C=C1)OC)OCCCOC)CC(C(CC(C(C)C)C(=O)NCC(C)(C)C(=O)N)O)N,"['Aliskiren', '173334-57-1', 'Rasilez', 'SPP100', 'SPP 100', 'aliskirene', 'Aliskireno', 'UNII-502FWN4Q32', 'CGP60536B', 'HSDB 7843']"
2520,"2-(3,4-dimethoxyphenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-2-propan-2-ylpentanenitrile",Ansyr,C27H38N2O4,454.6,CC(C)C(CCCN(C)CCC1=CC(=C(C=C1)OC)OC)(C#N)C2=CC(=C(C=C2)OC)OC,"['VERAPAMIL', '52-53-9', 'Iproveratril', 'Dilacoran', 'Isoptimo', 'Verapamilo', 'Verapamilum', 'D-365', 'Verapamilum [INN-Latin]', 'Verapamilo [INN-Spanish]']"
170014,"(2R)-2-(3,4-dimethoxyphenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-2-propan-2-ylpentanenitrile;hydrochloride",F82532,C27H39ClN2O4,491.1,CC(C)C(CCCN(C)CCC1=CC(=C(C=C1)OC)OC)(C#N)C2=CC(=C(C=C2)OC)OC.Cl,"['Dexverapamil Hydrochloride', '38176-02-2', '(R)-Verapamil Hydrochloride', 'Verapamil hydrochloride, (+)-', 'dexverapamil HCl', 'dexverapamil.HCl', '(+)-verapamil hydrochloride', 'UNII-B0P742MK5O', 'B0P742MK5O', 'CHEBI:77739']"
392622,"1,3-thiazol-5-ylmethyl N-[(2S,3S,5S)-3-hydroxy-5-[[(2S)-3-methyl-2-[[methyl-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]carbamoyl]amino]butanoyl]amino]-1,6-diphenylhexan-2-yl]carbamate",RTV,C37H48N6O5S2,720.9,CC(C)C1=NC(=CS1)CN(C)C(=O)NC(C(C)C)C(=O)NC(CC2=CC=CC=C2)CC(C(CC3=CC=CC=C3)NC(=O)OCC4=CN=CS4)O,"['ritonavir', '155213-67-5', 'Norvir', 'Abbott 84538', 'ABBOTT-84538', 'Empetus', 'Ritomune', 'Ritovir', 'Viriton', 'DRG-0244']"
16052011,acetic acid;(2S)-N-[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2R)-1-[[(2S)-1-[[(2S)-1-[(2S)-2-[(carbamoylamino)carbamoyl]pyrrolidin-1-yl]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-3-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]-5-oxopyrrolidine-2-carboxamide,ZDX,C61H88N18O16,1329.5,CC(C)CC(C(=O)NC(CCCN=C(N)N)C(=O)N1CCCC1C(=O)NNC(=O)N)NC(=O)C(COC(C)(C)C)NC(=O)C(CC2=CC=C(C=C2)O)NC(=O)C(CO)NC(=O)C(CC3=CNC4=CC=CC=C43)NC(=O)C(CC5=CN=CN5)NC(=O)C6CCC(=O)N6.CC(=O)O,"['Goserelin acetate', '145781-92-6', 'Fertilan', 'UNII-6YUU2PV0U8', '6YUU2PV0U8', 'DTXSID9046736', 'DTXCID7026736', 'GOSERELIN ACETATE (MART.)', 'GOSERELIN ACETATE [MART.]', 'GOSERELIN ACETATE (USP-RS)']"
72172,"(2S)-2-[[(2S,3R)-3-amino-2-hydroxy-4-phenylbutanoyl]amino]-4-methylpentanoic acid",Bestatin,C16H24N2O4,308.37,CC(C)CC(C(=O)O)NC(=O)C(C(CC1=CC=CC=C1)N)O,"['Bestatin', 'Ubenimex', '58970-76-6', 'Ubenimexum [Latin]', 'Ubenimexum', 'Ubenimex [INN:JAN]', 'NK-421', 'EINECS 261-529-2', 'NK 421', 'NSC 265489']"
11957481,"(2S)-2-[[(2S,3R)-3-amino-2-hydroxy-4-phenylbutanoyl]amino]-4-methylpentanoic acid;hydrochloride",B4000,C16H25ClN2O4,344.8,CC(C)CC(C(=O)O)NC(=O)C(C(CC1=CC=CC=C1)N)O.Cl,"['Bestatin hydrochloride', '65391-42-6', 'Ubenimex hydrochloride', '(-)-Bestatin hydrochloride', 'BY7Y2JX7NQ', 'L-LEUCINE, N-((2S,3R)-3-AMINO-2-HYDROXY-1-OXO-4-PHENYLBUTYL)-, HYDROCHLORIDE (1:1)', 'L-LEUCINE, N-((2S,3R)-3-AMINO-2-HYDROXY-1-OXO-4-PHENYLBUTYL)-, MONOHYDROCHLORIDE', 'DTXCID8025759', 'L-Leucine, N-[(2S,3R)-3-amino-2-hydroxy-1-oxo-4-phenylbutyl]-, hydrochloride (1:1)', '613-790-2']"
11595577,"(Z)-but-2-enedioic acid;1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine",Imiquimodmaleate,C18H20N4O4,356.4,CC(C)CN1C=NC2=C1C3=CC=CC=C3N=C2N.C(=CC(=O)O)C(=O)O,"['Imiquimod maleate', 'Imiquimod (maleate)', '896106-16-4', '(Z)-but-2-enedioic acid;1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine', 'Imiquimodmaleate', 'SCHEMBL3188539', 'HY-B0180B', 'AKOS030526972', 'CS-2060', 'DA-54285']"
13982876,"1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine;hydrochloride",HB8528,C14H17ClN4,276.76,CC(C)CN1C=NC2=C1C3=CC=CC=C3N=C2N.Cl,"['Imiquimod hydrochloride', '99011-78-6', 'Imiquimod (hydrochloride)', '1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine;hydrochloride', '1H-Imidazo[4,5-c]quinolin-4-amine, 1-(2-methylpropyl)-,monohydrochloride', '1-Isobutyl-1H-imidazo[4,5-c]quinolin-4-amine hydrochloride', 'Imiquimod HCl', 'Imiquimod hydrochloride?', 'SCHEMBL1301796', 'HY-B0180A']"
50922675,methyl N-[(2S)-1-[[4-[3-[5-chloro-2-fluoro-3-(methanesulfonamido)phenyl]-1-propan-2-ylpyrazol-4-yl]pyrimidin-2-yl]amino]propan-2-yl]carbamate,Braftovi,C22H27ClFN7O4S,540.0,CC(C)N1C=C(C(=N1)C2=C(C(=CC(=C2)Cl)NS(=O)(=O)C)F)C3=NC(=NC=C3)NCC(C)NC(=O)OC,"['Encorafenib', '1269440-17-6', 'LGX818', 'LGX-818', 'Braftovi', 'LGX 818', 'NVP-LGX818', 'NVP-LGX818-NXA', 'NVP-LGX-818-NXA', 'UNII-8L7891MRB6']"
126689157,"7-fluoro-3-methyl-8-[6-(3-piperidin-1-ylpropoxy)pyridin-3-yl]-1-propan-2-ylimidazo[4,5-c]quinolin-2-one",s8680,C27H32FN5O2,477.6,CC(C)N1C2=C(C=NC3=CC(=C(C=C32)C4=CN=C(C=C4)OCCCN5CCCCC5)F)N(C1=O)C,"['AZD1390', 'AZD-1390', '7-fluoro-3-methyl-8-[6-(3-piperidin-1-ylpropoxy)pyridin-3-yl]-1-propan-2-ylimidazo[4,5-c]quinolin-2-one', 'Azd 1390', 'UNII-CI43QFE22O', '2H-Imidazo(4,5-C)quinolin-2-one, 7-fluoro-1,3-dihydro-3-methyl-1-(1-methylethyl)-8-(6-(3-(1-piperidinyl)propoxy)-3-pyridinyl)-', '7-Fluoro-1-isopropyl-3-methyl-8-(-(3-(1-piperidinyl)propoxy)-3-pyridinyl)-1,3-dihydro-2himidazo(4,5-C)quinolin-2-one', '7-fluoro-3-methyl-8-(6-(3-piperidin-1-ylpropoxy)pyridin-3-yl)-1-propan-2-ylimidazo(4,5-c)quinolin-2-one', 'ATM Kinase Inhibitor AZD1390', '2089288-03-7']"
45375953,"5-(4-amino-1-propan-2-ylpyrazolo[3,4-d]pyrimidin-3-yl)-1,3-benzoxazol-2-amine",Sapanisertib,C15H15N7O,309.33,CC(C)N1C2=NC=NC(=C2C(=N1)C3=CC4=C(C=C3)OC(=N4)N)N,"['Sapanisertib', 'INK-128', 'MLN0128', 'INK 128', 'MLN-0128', 'TAK-228', 'UNII-JGH0DF1U03', 'JGH0DF1U03', 'CB-228', '1H-Pyrazolo[3,4-d]pyrimidin-4-amine, 3-(2-amino-5-benzoxazolyl)-1-(1-methylethyl)-']"
135565635,"2-(4-amino-1-propan-2-ylpyrazolo[3,4-d]pyrimidin-3-yl)-1H-indol-5-ol",TORKinib,C16H16N6O,308.34,CC(C)N1C2=NC=NC(=C2C(=N1)C3=CC4=C(N3)C=CC(=C4)O)N,"['PP242', '1092351-67-1', 'TORKinib', 'PP-242', '2-(4-amino-1-isopropyl-1H-pyrazolo[3,4-d]pyrimidin-3-yl)-1H-indol-5-ol', 'PP 242', 'Torkinib (PP242)', 'H5669VNZ7V', 'DTXSID5048685', 'CHEBI:90679']"
11950170,2-[3-[4-(1H-indazol-5-ylamino)quinazolin-2-yl]phenoxy]-N-propan-2-ylacetamide,ICQ,C26H24N6O2,452.5,CC(C)NC(=O)COC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=N2)NC4=CC5=C(C=C4)NN=C5,"['Belumosudil', 'SLx 2119', 'UNII-834YJF89WO', 'Slx-2119 free base', 'Rock2 inhibitor kd025', 'SLx2119', '834YJF89WO', 'Acetamide, 2-(3-(4-(1H-indazol-5-ylamino)-2-quinazolinyl)phenoxy)-N-(1-methylethyl)-', '2-[3-[4-(1H-indazol-5-ylamino)-2-quinazolinyl]phenoxy]-N-(1-methylethyl)-acetamide', '2-(3-(4-(1H-indazol-5-ylamino)-2-quinazolinyl)phenoxy)-N-(1-methylethyl)-acetamide']"
146681181,2-[3-[4-(1H-indazol-5-ylamino)quinazolin-2-yl]phenoxy]-N-propan-2-ylacetamide;methanesulfonic acid,Rezurock,C27H28N6O5S,548.6,CC(C)NC(=O)COC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=N2)NC4=CC5=C(C=C4)NN=C5.CS(=O)(=O)O,"['Belumosudil mesylate (KD025 mesylate)', 'Belumosudil (mesylate)', 'Rezurock', 'Belumosudil/KD-025', 'CHEMBL4802130', 'SCHEMBL23777554', 'EX-A2314A', 'HY-15307A', 'BELUMOSUDIL MESYLATE [WHO-DD]', 'AKOS040757297']"
104769,methyl 3-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]propanoate;hydrochloride,CLOL,C16H26ClNO4,331.8,CC(C)NCC(COC1=CC=C(C=C1)CCC(=O)OC)O.Cl,"['Esmolol hydrochloride', '81161-17-3', 'Esmolol HCL', 'HSDB 6530', 'Brevibloc in plastic container', 'UNII-V05260LC8D', 'CLOL', 'DTXSID7049003', 'V05260LC8D', 'CHEBI:4857']"
67462786,"N'-(3,5-dimethoxyphenyl)-N'-[3-(1-methylpyrazol-4-yl)quinoxalin-6-yl]-N-propan-2-ylethane-1,2-diamine",Balversa,C25H30N6O2,446.5,CC(C)NCCN(C1=CC2=NC(=CN=C2C=C1)C3=CN(N=C3)C)C4=CC(=CC(=C4)OC)OC,"['Erdafitinib', 'Balversa', 'UNII-890E37NHMV', '890E37NHMV', 'JNJ42756493', '1,2-Ethanediamine, N1-(3,5-dimethoxyphenyl)-N2-(1-methylethyl)-N1-(3-(1-methyl-1H-pyrazol-4-yl)-6-quinoxalinyl)-', 'PAN-FGFR TYROSINE KINASE INHIBITOR JNJ-42756493', 'compound 4 (WO2011135376)', 'compound 4 [WO2011135376]', 'erdafitinibum']"
4006,"dipropan-2-yl 2-(1,3-dithiol-2-ylidene)propanedioate",Kantec,C12H16O4S2,288.4,CC(C)OC(=O)C(=C1SC=CS1)C(=O)OC(C)C,"['malotilate', '59937-28-9', 'Kantec', 'NKK 105', 'NKK-105', 'dipropan-2-yl 2-(1,3-dithiol-2-ylidene)propanedioate', 'Malotilato', 'Diisopropyl 1,3-dithiol-2-ylidenemalonate', 'Hepation', 'Diisopropyl 2-(1,3-dithiol-2-ylidene)malonate']"
3339,propan-2-yl 2-[4-(4-chlorobenzoyl)phenoxy]-2-methylpropanoate,FNF,C20H21ClO4,360.8,CC(C)OC(=O)C(C)(C)OC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)Cl,"['fenofibrate', '49562-28-9', 'Procetofen', 'Lipantil', 'Lipidil', 'Antara', 'Fenobrate', 'Triglide', 'Secalip', 'Fenoglide']"
58282870,"(3S)-3-methylsulfanyl-1-[2-[4-[4-(1-methyl-1,2,4-triazol-3-yl)phenyl]-3,6-dihydro-2H-pyridin-1-yl]-2-oxoethyl]-N-[3-(6-propan-2-yloxypyridin-3-yl)-1H-indazol-5-yl]pyrrolidine-3-carboxamide",s8701,C37H41N9O3S,691.8,CC(C)OC1=NC=C(C=C1)C2=NNC3=C2C=C(C=C3)NC(=O)C4(CCN(C4)CC(=O)N5CCC(=CC5)C6=CC=C(C=C6)C7=NN(C=N7)C)SC,"['MK-8353', '1184173-73-6', 'SCH900353', 'MK8353', 'SCH-900353', '(3S)-3-methylsulfanyl-1-[2-[4-[4-(1-methyl-1,2,4-triazol-3-yl)phenyl]-3,6-dihydro-2H-pyridin-1-yl]-2-oxoethyl]-N-[3-(6-propan-2-yloxypyridin-3-yl)-1H-indazol-5-yl]pyrrolidine-3-carboxamide', 'MK 8353', 'CHEBI:167664', '(3S)-3-(methylsulfanyl)-1-(2-{4-[4-(1-methyl-1H-1,2,4-triazol-3-yl)phenyl]-3,6-dihydropyridin-1(2H)-yl}-2-oxoethyl)-N-{3-[6-(propan-2-yloxy)pyridin-3-yl]-1H-indazol-5-yl}pyrrolidine-3-carboxamide', '(3S)-3-(methylsulfanyl)-1-(2-(4-(4-(1-methyl-1H-1,2,4-triazol-3-yl)phenyl)-3,6-dihydropyridin-1(2H)-yl)-2-oxoethyl)-N-(3-(6-(propan-2-yloxy)pyridin-3-yl)-1H-indazol-5-yl)pyrrolidine-3-carboxamide']"
11626560,"3-[(1R)-1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-(1-piperidin-4-ylpyrazol-4-yl)pyridin-2-amine",VGH,C21H22Cl2FN5O,450.3,CC(C1=C(C=CC(=C1Cl)F)Cl)OC2=C(N=CC(=C2)C3=CN(N=C3)C4CCNCC4)N,"['Crizotinib', '877399-52-5', '(R)-crizotinib', 'PF-2341066', 'PF 2341066', '(R)-3-(1-(2,6-dichloro-3-fluorophenyl)ethoxy)-5-(1-(piperidin-4-yl)-1H-pyrazol-4-yl)pyridin-2-amine', 'crizotinibum', 'UNII-53AH36668S', 'CHEBI:64310', 'PF2341066']"
56671814,"3-[(1S)-1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-(1-piperidin-4-ylpyrazol-4-yl)pyridin-2-amine",VHS,C21H22Cl2FN5O,450.3,CC(C1=C(C=CC(=C1Cl)F)Cl)OC2=C(N=CC(=C2)C3=CN(N=C3)C4CCNCC4)N,"['(S)-crizotinib', 'ent-crizotinib', 'CHEBI:77555', '3-[(1s)-1-(2,6-Dichloro-3-Fluorophenyl)ethoxy]-5-(1-Piperidin-4-Ylpyrazol-4-Yl)pyridin-2-Amine', '3-((1S)-1-(2,6-dichloro-3-fluorophenyl)ethoxy)-5-(1-piperidin-4-ylpyrazol-4-yl)pyridin-2-amine', '1374356-45-2', '2-Pyridinamine, 3-[(1S)-1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-[1-(4-piperidinyl)-1H-pyrazol-4-yl]-', 'CHEMBL1825141', '(S)-3-(1-(2,6-DICHLORO-3-FLUOROPHENYL)ETHOXY)-5-(1-(PIPERIDIN-4-YL)-1H-PYRAZOL-4-YL)PYRIDIN-2-AMINE', '3-[(1S)-1-(2,6-Dichloro-3-fluorophenyl)ethoxy]-5-[1-(4-piperidinyl)-1H-pyrazol-4-yl]-2-pyridinamine']"
71576688,"3-[(1R)-1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-(1-piperidin-4-ylpyrazol-4-yl)pyridin-2-amine;hydrochloride",s5190,C21H23Cl3FN5O,486.8,CC(C1=C(C=CC(=C1Cl)F)Cl)OC2=C(N=CC(=C2)C3=CN(N=C3)C4CCNCC4)N.Cl,"['1415560-69-8', '2-Pyridinamine, 3-[(1R)-1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-[1-(4-piperidinyl)-1H-pyrazol-4-yl]-, hydrochloride (1:1)', '2-Pyridinamine, 3-((1R)-1-(2,6-dichloro-3-fluorophenyl)ethoxy)-5-(1-(4-piperidinyl)-1H-pyrazol-4-yl)-, hydrochloride (1:1)', 'Crizotinib hydrochloride', 'Crizotinib (hydrochloride)', '3-[(1R)-1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-(1-piperidin-4-ylpyrazol-4-yl)pyridin-2-amine;hydrochloride', 'Crizotinib HCl', 'PF02341066 hydrochloride', 'Z63P44CE4Z', 'DTXSID20856162']"
135413536,"3-[[(2R,3S)-2-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)morpholin-4-yl]methyl]-1,4-dihydro-1,2,4-triazol-5-one",Emend,C23H21F7N4O3,534.4,CC(C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)OC2C(N(CCO2)CC3=NNC(=O)N3)C4=CC=C(C=C4)F,"['Aprepitant', '170729-80-3', 'MK-0869', 'Aponvie', 'Cinvanti', 'aprepitantum', 'MK 0869', 'UNII-1NF15YR6UY', 'ONO-7436', '1NF15YR6UY']"
156419,N-[(1R)-1-naphthalen-1-ylethyl]-3-[3-(trifluoromethyl)phenyl]propan-1-amine,CNC,C22H22F3N,357.4,CC(C1=CC=CC2=CC=CC=C21)NCCCC3=CC(=CC=C3)C(F)(F)F,"['Cinacalcet', '226256-56-0', 'AMG-073', 'KRN1493', 'UNII-UAZ6V7728S', 'UAZ6V7728S', 'CHEBI:48390', 'HSDB 7318', 'KRN-1493', 'N-((1R)-1-(Naphthalen-1-yl)ethyl)-3-(3-(trifluoromethyl)phenyl)propan-1-amine']"
156391,(2S)-2-(6-methoxynaphthalen-2-yl)propanoic acid,Duk,C14H14O3,230.26,CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)O,"['NAPROXEN', '22204-53-1', '(S)-Naproxen', 'Naprosyn', 'Naproxene', '(+)-Naproxen', 'Equiproxen', 'Naproxeno', '(S)-(+)-Naproxen', 'd-Naproxen']"
60490,1-[1-(1-benzothiophen-2-yl)ethyl]-1-hydroxyurea,Zyflo,C11H12N2O2S,236.29,CC(C1=CC2=CC=CC=C2S1)N(C(=O)N)O,"['ZILEUTON', '111406-87-2', 'Leutrol', 'Zyflo CR', 'Zileutonum', 'Zileutonum [INN-Latin]', 'N-(1-Benzo(b)thien-2-ylethyl)-N-hydroxyurea', 'ABBOTT-64077', 'UNII-V1L22WVE2S', 'V1L22WVE2S']"
71616,"(2R,3S)-2-(2,4-difluorophenyl)-3-(5-fluoropyrimidin-4-yl)-1-(1,2,4-triazol-1-yl)butan-2-ol",VCZ,C16H14F3N5O,349.31,CC(C1=NC=NC=C1F)C(CN2C=NC=N2)(C3=C(C=C(C=C3)F)F)O,"['Voriconazole', '137234-62-9', 'Voriconazol', 'Voriconazolum', 'Vorikonazole', 'DRG-0301', 'VFEND I.V.', 'UNII-JFU09I87TR', 'JFU09I87TR', 'NSC-759888']"
2563,"3-(3,4-dihydroxyphenyl)-2-hydrazinyl-2-methylpropanoic acid",Lodosin,C10H14N2O4,226.23,CC(CC1=CC(=C(C=C1)O)O)(C(=O)O)NN,"['302-53-4', 'dl-Carbidopa', 'D,L-Carbidopa', '3-(3,4-dihydroxyphenyl)-2-hydrazinyl-2-methylpropanoic acid', 'Carbidopa, dl-', 'D,L CARBIDOPA', 'Carbidopa, dl- anhydrous', 'Carbidopa anhydrous, DL-', 'Carbidopa DL-form [MI]', '14585-65-0']"
5312125,"1-(3-hydroxypropyl)-5-[(2R)-2-[2-[2-(2,2,2-trifluoroethoxy)phenoxy]ethylamino]propyl]-2,3-dihydroindole-7-carboxamide",Urief,C25H32F3N3O4,495.5,CC(CC1=CC2=C(C(=C1)C(=O)N)N(CC2)CCCO)NCCOC3=CC=CC=C3OCC(F)(F)F,"['Silodosin', '160970-54-7', 'Rapaflo', 'Urief', 'Silodyx', 'Urorec', 'Rapilif', 'Silodal', 'Rapflo', 'KAD-3213']"
67171867,N-[(2S)-1-[3-(3-chloro-4-cyanophenyl)pyrazol-1-yl]propan-2-yl]-5-(1-hydroxyethyl)-1H-pyrazole-3-carboxamide,Nubeqa,C19H19ClN6O2,398.8,CC(CN1C=CC(=N1)C2=CC(=C(C=C2)C#N)Cl)NC(=O)C3=NNC(=C3)C(C)O,"['Darolutamide', 'ODM-201', 'Nubeqa', 'BAY-1841788', 'BAY1841788', 'darolutamida', 'X05U0N2RCO', 'BAY 1841788', 'ODM201', 'UNII-X05U0N2RCO']"
167811,1-[1-(2-benzylphenoxy)propan-2-yl]piperidine;phosphoric acid,Pirexyl,C21H30NO5P,407.4,CC(COC1=CC=CC=C1CC2=CC=CC=C2)N3CCCCC3.OP(=O)(O)O,"['benproperine phosphate', '19428-14-9', 'Pirexyl', '3563-76-6', 'Benproperine (phosphate)', 'Benproperine trihydrogen phosphate', 'Benproperine phosphate [JAN]', 'Piperidine, 1-[1-methyl-2-[2-(phenylmethyl)phenoxy]ethyl]-, phosphate(1:1)', 'Blascorid', 'S831Z48C5W']"
2375,N-[4-cyano-3-(trifluoromethyl)phenyl]-3-(4-fluorophenyl)sulfonyl-2-hydroxy-2-methylpropanamide,Bical,C18H14F4N2O4S,430.4,CC(CS(=O)(=O)C1=CC=C(C=C1)F)(C(=O)NC2=CC(=C(C=C2)C#N)C(F)(F)F)O,"['bicalutamide', '90357-06-5', 'Casodex', 'Cosudex', 'Calutide', 'ICI 176334', 'ICI-176334', 'bicalutamida', 'ICI 176,334', 'A0Z3NAU9DP']"
44093,(2S)-1-[(2S)-2-methyl-3-sulfanylpropanoyl]pyrrolidine-2-carboxylic acid,Zapto,C9H15NO3S,217.29,CC(CS)C(=O)N1CCCC1C(=O)O,"['captopril', '62571-86-2', 'Captopryl', 'Cesplon', 'Garranil', 'Acepress', 'Captolane', 'Captoril', 'Tensoprel', 'Dilabar']"
54755438,6-amino-9-[(3R)-1-but-2-ynoylpyrrolidin-3-yl]-7-(4-phenoxyphenyl)purin-8-one,Velexbru,C25H22N6O3,454.5,CC#CC(=O)N1CCC(C1)N2C3=NC=NC(=C3N(C2=O)C4=CC=C(C=C4)OC5=CC=CC=C5)N,"['Tirabrutinib', 'ONO-4059', 'GS-4059', 'Tirabrutinib [INN]', 'Velexbru', 'ONO-4059(Free base)', 'LXG44NDL2T', 'ONO4059', 'UNII-LXG44NDL2T', '6-amino-9-[(3R)-1-but-2-ynoylpyrrolidin-3-yl]-7-(4-phenoxyphenyl)purin-8-one']"
71571562,6-amino-9-[(3R)-1-but-2-ynoylpyrrolidin-3-yl]-7-(4-phenoxyphenyl)purin-8-one;hydrochloride,s8166,C25H23ClN6O3,490.9,CC#CC(=O)N1CCC(C1)N2C3=NC=NC(=C3N(C2=O)C4=CC=C(C=C4)OC5=CC=CC=C5)N.Cl,"['1439901-97-9', 'Tirabrutinib hydrochloride', 'ONO-4059 Hydrochloride', 'GS-4059 hydrochloride', 'Velexbru (TN)', 'U374135N48', 'UNII-U374135N48', 'TIRABRUTINIB HYDROCHLORIDE [JAN]', 'TIRABRUTINIB HYDROCHLORIDE [WHO-DD]', 'Tirabrutinib hydrochloride (JAN)']"
55245,"(8S,11R,13S,14S,17S)-11-[4-(dimethylamino)phenyl]-17-hydroxy-13-methyl-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one",Korlym,C29H35NO2,429.6,CC#CC1(CCC2C1(CC(C3=C4CCC(=O)C=C4CCC23)C5=CC=C(C=C5)N(C)C)C)O,"['mifepristone', '84371-65-3', 'RU-486', 'Korlym', 'RU486', 'RU 486', 'Mifepristona', 'Mifepriston', 'RU 38486', 'RU-38486']"
146673142,"disodium;[6-[[5-fluoro-2-(3,4,5-trimethoxyanilino)pyrimidin-4-yl]amino]-2,2-dimethyl-3-oxopyrido[3,2-b][1,4]oxazin-4-yl]methyl phosphate;hexahydrate",HY-13038B,C23H36FN6Na2O15P,732.5,CC1(C(=O)N(C2=C(O1)C=CC(=N2)NC3=NC(=NC=C3F)NC4=CC(=C(C(=C4)OC)OC)OC)COP(=O)([O-])[O-])C.O.O.O.O.O.O.[Na+].[Na+],"['Fostamatinib (disodium hexahydrate)', 'GLXC-22737', 'HY-13038B']"
121408882,"6,6-dimethyl-2-[2-[(2-methylpyrazol-3-yl)amino]pyrimidin-4-yl]-5-(2-morpholin-4-ylethyl)thieno[2,3-c]pyrrol-4-one",Temuterkib,C22H27N7O2S,453.6,CC1(C2=C(C=C(S2)C3=NC(=NC=C3)NC4=CC=NN4C)C(=O)N1CCN5CCOCC5)C,"['Temuterkib', 'LY3214996', 'LY-3214996', 'Temuterkib [USAN]', 'V0Q46LFE6F', 'LY 3214996', 'TEMUTERKIB [INN]', 'Temuterkib (USAN)', '[14c]-ly3214996', '(14c)-ly3214996']"
54704426,"(4S,4aS,5aS,6S,12aR)-4-(dimethylamino)-1,6,10,11,12a-pentahydroxy-6-methyl-3,12-dioxo-4,4a,5,5a-tetrahydrotetracene-2-carboxamide;hydrochloride",Retet,C22H25ClN2O8,480.9,CC1(C2CC3C(C(=O)C(=C(C3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)N)N(C)C)O.Cl,"['TETRACYCLINE HYDROCHLORIDE', 'Tetracycline HCl', 'Achromycin hydrochloride', 'Bristacycline', 'Cyclopar', 'Sumycin', 'Tetrachel', 'Neocycline b', 'Vetquamycin 324', 'Supramycin']"
14982,"(2S,3S,4S,5R,6R)-6-[(2S,3R,4S,5S,6S)-2-[[(3S,4aR,6aR,6bS,8aS,11S,12aR,14aR,14bS)-11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl]oxy]-6-carboxy-4,5-dihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid",Glycyron,C42H62O16,822.9,CC1(C2CCC3(C(C2(CCC1OC4C(C(C(C(O4)C(=O)O)O)O)OC5C(C(C(C(O5)C(=O)O)O)O)O)C)C(=O)C=C6C3(CCC7(C6CC(CC7)(C)C(=O)O)C)C)C)C,"['Glycyrrhizic acid', 'glycyrrhizin', '1405-86-3', 'Glycyron', 'Glycyrrhizinic acid', 'Glycyrrhetinic acid glycoside', 'potenlini', 'Glizigen', 'glycyrrhizate', '18-beta-Glycyrrhizic acid']"
656656,"(2S,3S,4S,5R,6R)-6-[(2S,3R,4S,5S,6S)-2-[[(3S,4aR,6aR,6bS,8aS,11S,12aR,14aR,14bS)-11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl]oxy]-6-carboxy-4,5-dihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid;azane",D02028,C42H68N2O16,857.0,CC1(C2CCC3(C(C2(CCC1OC4C(C(C(C(O4)C(=O)O)O)O)OC5C(C(C(C(O5)C(=O)O)O)O)O)C)C(=O)C=C6C3(CCC7(C6CC(CC7)(C)C(=O)O)C)C)C)C.N.N,"['Diammonium glycyrrhizinate', '79165-06-3', 'UNII-A9ZZD585U6', 'A9ZZD585U6', 'Glycyrrhizic acid, diammonium salt', '18beta-Glycyrrhizic acid diammonium salt', 'MFCD00167400', '(2S,3S,4S,5R,6R)-6-[(2S,3R,4S,5S,6S)-2-[[(3S,4aR,6aR,6bS,8aS,11S,12aR,14aR,14bS)-11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl]oxy]-6-carboxy-4,5-dihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid;azane', 'Diammonium glycyrrhizinate (JAN)', 'DIAMMONIUM GLYCYRRHIZINATE [JAN]']"
49846579,"4-[4-[[2-(4-chlorophenyl)-4,4-dimethylcyclohexen-1-yl]methyl]piperazin-1-yl]-N-[3-nitro-4-(oxan-4-ylmethylamino)phenyl]sulfonyl-2-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)benzamide",Venclexta,C45H50ClN7O7S,868.4,CC1(CCC(=C(C1)C2=CC=C(C=C2)Cl)CN3CCN(CC3)C4=CC(=C(C=C4)C(=O)NS(=O)(=O)C5=CC(=C(C=C5)NCC6CCOCC6)[N+](=O)[O-])OC7=CN=C8C(=C7)C=CN8)C,"['Venetoclax', '1257044-40-8', 'ABT-199', 'Venclexta', 'GDC-0199', 'ABT199', 'venclyxto', 'ABT 199', 'RG7601', 'GDC 0199']"
6480466,"(2R)-2-methyl-6-nitro-2-[[4-[4-[4-(trifluoromethoxy)phenoxy]piperidin-1-yl]phenoxy]methyl]-3H-imidazo[2,1-b][1,3]oxazole",Delamanid,C25H25F3N4O6,534.5,CC1(CN2C=C(N=C2O1)[N+](=O)[O-])COC3=CC=C(C=C3)N4CCC(CC4)OC5=CC=C(C=C5)OC(F)(F)F,"['Delamanid', '681492-22-8', 'OPC-67683', 'deltyba', 'Delamanid [USAN]', 'OPC 67683', '8OOT6M1PC7', 'Deltyba (TN)', 'DELAMANID [INN]', 'DELAMANID [JAN]']"
5311068,"5-[(1S)-1-(2,3-dimethylphenyl)ethyl]-1H-imidazole",DEXMEDETOMIDINE,C13H16N2,200.28,CC1=C(C(=CC=C1)C(C)C2=CN=CN2)C,"['DEXMEDETOMIDINE', '113775-47-6', 'Dexmedetomidina', 'Dexmedetomidinum', 'MPV 1440', '5-[(1S)-1-(2,3-dimethylphenyl)ethyl]-1H-imidazole', '4-[(1S)-1-(2,3-dimethylphenyl)ethyl]-1H-imidazole', '(+)-4-((S)-alpha,2,3-Trimethylbenzyl)imidazole', 'MPV-1440', 'Medetomidine, (s)-']"
56959,"N-(2,6-dimethylphenyl)-2-[4-[2-hydroxy-3-(2-methoxyphenoxy)propyl]piperazin-1-yl]acetamide",Ranexa,C24H33N3O4,427.5,CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)CC(COC3=CC=CC=C3OC)O,"['RANOLAZINE', '95635-55-5', 'CVT-303', 'RAN D', 'Ran4', 'RS-43285-003', '(+-)-Ranolazine', 'ASPRUZYO', 'Ranolazina', 'UNII-A6IEZ5M406']"
92727,"(2S)-N-[(2S,4S,5S)-5-[[2-(2,6-dimethylphenoxy)acetyl]amino]-4-hydroxy-1,6-diphenylhexan-2-yl]-3-methyl-2-(2-oxo-1,3-diazinan-1-yl)butanamide",LPV,C37H48N4O5,628.8,CC1=C(C(=CC=C1)C)OCC(=O)NC(CC2=CC=CC=C2)C(CC(CC3=CC=CC=C3)NC(=O)C(C(C)C)N4CCCNC4=O)O,"['Lopinavir', '192725-17-0', 'Aluviran', 'Koletra', 'ABT 378', 'A-157378.0', 'Lopinavirum', 'CHEBI:31781', 'Lopinavir-', 'A-157378-0']"
119607,"4-(5-methyl-3-phenyl-1,2-oxazol-4-yl)benzenesulfonamide",COX,C16H14N2O3S,314.4,CC1=C(C(=NO1)C2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)N,"['Valdecoxib', '181695-72-7', 'Bextra', 'Valdyn', 'SC-65872', 'SC 65872', 'Benzenesulfonamide, 4-(5-methyl-3-phenyl-4-isoxazolyl)-', '4-(5-Methyl-3-phenyl-4-isoxazolyl)benzenesulfonamide', '4-(5-methyl-3-phenyl-1,2-oxazol-4-yl)benzenesulfonamide', 'valdecoxibum']"
23675320,"sodium;(2S,5R,6R)-6-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate",Tegopen,C19H17ClN3NaO5S,457.9,CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)NC3C4N(C3=O)C(C(S4)(C)C)C(=O)[O-].[Na+],"['Cloxacillin sodium', '642-78-4', 'Sodium cloxacillin', 'Ankerbin', 'Cloxacillin sodium anhydrous', 'Sodium orbenin', 'Sodium syntarpen', 'Monosodium cloxacillin', 'Staphybiotic', 'Austrastaph']"
24785956,"sodium;4-[[(1R)-2-[5-(2-fluoro-3-methoxyphenyl)-3-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-4-methyl-2,6-dioxopyrimidin-1-yl]-1-phenylethyl]amino]butanoate",Orlissa,C32H29F5N3NaO5,653.6,CC1=C(C(=O)N(C(=O)N1CC2=C(C=CC=C2F)C(F)(F)F)CC(C3=CC=CC=C3)NCCCC(=O)[O-])C4=C(C(=CC=C4)OC)F.[Na+],"['Elagolix sodium', '832720-36-2', 'Elagolix sodium salt', 'Orlissa', 'NBI-56418 NA', 'UNII-5948VUI423', 'NBI-56418-NA', '5948VUI423', 'ORIAHNN COMPONENT ELAGOLIX SODIUM', 'Butanoic acid, 4-(((1R)-2-(5-(2-fluoro-3-methoxyphenyl)-3-((2-fluoro-6-(trifluoromethyl)phenyl)methyl)-3,6-dihydro-4-methyl-2,6-dioxo-1(2H)-pyrimidinyl)-1-phenylethyl)amino)-, monosodium salt']"
5330286,"6-acetyl-8-cyclopentyl-5-methyl-2-[(5-piperazin-1-ylpyridin-2-yl)amino]pyrido[2,3-d]pyrimidin-7-one",LQQ,C24H29N7O2,447.5,CC1=C(C(=O)N(C2=NC(=NC=C12)NC3=NC=C(C=C3)N4CCNCC4)C5CCCC5)C(=O)C,"['Palbociclib', '571190-30-2', 'UNII-G9ZF61LE7G', 'G9ZF61LE7G', 'CHEBI:85993', 'PD 332991', '6-Acetyl-8-cyclopentyl-5-methyl-2-(5-piperazin-1-ylpyridin-2-ylamino)-8H-pyrido(2,3-d)pyrimidin-7-one', '6-Acetyl-8-cyclopentyl-5-methyl-2-[[5-(piperazin-1-yl)pyridin-2-yl]amino]-8H-pyrido[2,3-d]pyrimidin-7-one', 'Pyrido(2,3-d)pyrimidin-7(8H)-one, 6-acetyl-8-cyclopentyl-5-methyl-2-((5-(1-piperazinyl)-2-pyridinyl)amino)-', '6-ACETYL-8-CYCLOPENTYL-5-METHYL-2-((5-(PIPERAZIN-1-YL)PYRIDIN-2-YL)AMINO(PYRIDO(2,3-D)PYRIMIDIN-7(8H)-ONE']"
444795,"(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoic acid",ATRA,C20H28O2,300.4,CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CC(=O)O)C)C,"['tretinoin', 'ATRA', 'Renova', 'Aknefug', 'Atralin', 'Retin-A Micro', 'Tretinoina', 'Effederm', 'Avita', 'Tretinoino']"
22049997,"3-[3-bromo-4-[(2,4-difluorophenyl)methoxy]-6-methyl-2-oxopyridin-1-yl]-N,4-dimethylbenzamide",I45,C22H19BrF2N2O3,477.3,CC1=C(C=C(C=C1)C(=O)NC)N2C(=CC(=C(C2=O)Br)OCC3=C(C=C(C=C3)F)F)C,"['PH-797804', '586379-66-0', 'PH 797804', '3-(3-Bromo-4-((2,4-difluorobenzyl)oxy)-6-methyl-2-oxopyridin-1(2H)-yl)-N,4-dimethylbenzamide', 'PH797804', '3-[3-bromo-4-[(2,4-difluorophenyl)methoxy]-6-methyl-2-oxopyridin-1-yl]-N,4-dimethylbenzamide', 'PHA-797804', 'CHEBI:82715', 'SI09I1V827', '3-{3-Bromo-4-[(2,4-Difluorobenzyl)oxy]-6-Methyl-2-Oxopyridin-1(2h)-Yl}-N,4-Dimethylbenzamide']"
24826799,"3-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]benzamide",PONATINIB,C29H27F3N6O,532.6,CC1=C(C=C(C=C1)C(=O)NC2=CC(=C(C=C2)CN3CCN(CC3)C)C(F)(F)F)C#CC4=CN=C5N4N=CC=C5,"['PONATINIB', '943319-70-8', '3-(imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methyl-N-(4-((4-methylpiperazin-1-yl)methyl)-3-(trifluoromethyl)phenyl)benzamide', 'ponatinibum', 'UNII-4340891KFS', 'CHEBI:78543', 'HSDB 8184', '4340891KFS', 'DTXSID50241426', '3-(Imidazo[1,2-B]pyridazin-3-Ylethynyl)-4-Methyl-N-{4-[(4-Methylpiperazin-1-Yl)methyl]-3-(Trifluoromethyl)phenyl}benzamide']"
16063245,4-methyl-N-[3-(4-methylimidazol-1-yl)-5-(trifluoromethyl)phenyl]-3-[(4-pyrazin-2-ylpyrimidin-2-yl)amino]benzamide,Radotinib,C27H21F3N8O,530.5,CC1=C(C=C(C=C1)C(=O)NC2=CC(=CC(=C2)C(F)(F)F)N3C=C(N=C3)C)NC4=NC=CC(=N4)C5=NC=CN=C5,"['Radotinib', '926037-48-1', 'supect', 'IY-5511', 'Radotinib [INN]', 'IY5511', 'IY5511HCl', '4-methyl-N-[3-(4-methylimidazol-1-yl)-5-(trifluoromethyl)phenyl]-3-[(4-pyrazin-2-ylpyrimidin-2-yl)amino]benzamide', '4-methyl-N-(3-(4-methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)phenyl)-3-((4-(pyrazin-2-yl)pyrimidin-2-yl)amino)benzamide', 'UNII-I284LJY110']"
16747388,"4-methyl-3-[(1-methyl-6-pyridin-3-ylpyrazolo[3,4-d]pyrimidin-4-yl)amino]-N-[3-(trifluoromethyl)phenyl]benzamide",DXH,C26H20F3N7O,503.5,CC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)C(F)(F)F)NC3=C4C=NN(C4=NC(=N3)C5=CN=CC=C5)C,"['NVP-BHG712', '940310-85-0', '4-methyl-3-(1-methyl-6-(pyridin-3-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-ylamino)-N-(3-(trifluoromethyl)phenyl)benzamide', 'NVP-BHG 712', 'BHG712', '4-Methyl-3-[[1-methyl-6-(3-pyridinyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide', 'BHG-712', '4-methyl-3-((1-methyl-6-(pyridin-3-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl)amino)-N-(3-(trifluoromethyl)phenyl)benzamide', 'N86NEM4R7Q', '4-methyl-3-[(1-methyl-6-pyridin-3-yl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]-~{N}-[3-(trifluoromethyl)phenyl]benzamide']"
24812758,"(2S,3R,4R,5S,6R)-2-[3-[[5-(4-fluorophenyl)thiophen-2-yl]methyl]-4-methylphenyl]-6-(hydroxymethyl)oxane-3,4,5-triol",Invokana,C24H25FO5S,444.5,CC1=C(C=C(C=C1)C2C(C(C(C(O2)CO)O)O)O)CC3=CC=C(S3)C4=CC=C(C=C4)F,"['(2S,3R,4R,5S,6R)-2-[3-[[5-(4-fluorophenyl)thiophen-2-yl]methyl]-4-methylphenyl]-6-(hydroxymethyl)oxane-3,4,5-triol', '(2S,3R,4R,5S,6R)-2-(3-{[5-(4-fluorophenyl)thiophen-2-yl]methyl}-4-methylphenyl)-6-(hydroxymethyl)oxane-3,4,5-triol', '(2S,3R,4R,5S,6R)-2-(3-((5-(4-fluorophenyl)thiophen-2-yl)methyl)-4-methylphenyl)-6-(hydroxymethyl)oxane-3,4,5-triol', '695-192-1', 'Canagliflozin', '842133-18-0', 'Invokana', 'Canagliflozin anhydrous', 'TA-7284', 'JNJ-28431754']"
45256689,5-[[6-chloro-5-(4-phenylphenyl)-1H-benzimidazol-2-yl]oxy]-2-methylbenzoic acid,s8803,C27H19ClN2O3,454.9,CC1=C(C=C(C=C1)OC2=NC3=C(N2)C=C(C(=C3)C4=CC=C(C=C4)C5=CC=CC=C5)Cl)C(=O)O,"['MK-3903', '1219737-12-8', 'MK 3903', 'CHEMBL4082745', ""5-((6-([1,1'-biphenyl]-4-yl)-5-chloro-1H-benzo[d]imidazol-2-yl)oxy)-2-methylbenzoic acid"", ""5-((5-([1,1'-biphenyl]-4-yl)-6-chloro-1H-benzo[d]imidazol-2-yl)oxy)-2-methylbenzoic acid"", 'CID 45256689', 'SCHEMBL3036566', 'FIKQZQDYGXAUHC-UHFFFAOYSA-N', 'BCP29075']"
45256693,5-[[6-chloro-5-(1-methylindol-5-yl)-1H-benzimidazol-2-yl]oxy]-2-methylbenzoic acid,4cfe,C24H18ClN3O3,431.9,CC1=C(C=C(C=C1)OC2=NC3=C(N2)C=C(C(=C3)C4=CC5=C(C=C4)N(C=C5)C)Cl)C(=O)O,"['1219739-36-2', 'Ex229', 'ex-229', 'EX-229 free acid', 'ex229 (compound 991)', '5-[[6-Chloranyl-5-(1-Methylindol-5-Yl)-1h-Benzimidazol-2-Yl]oxy]-2-Methyl-Benzoic Acid', 'CHEMBL3393127', '5-((6-chloro-5-(1-methyl-1H-indol-5-yl)-1H-benzo[d]imidazol-2-yl)oxy)-2-methylbenzoic acid', '5-{[6-chloro-5-(1-methyl-1H-indol-5-yl)-1H-1,3-benzodiazol-2-yl]oxy}-2-methylbenzoic acid', '5-[[6-Chloro-5-(1-methylindol-5-yl)-1H-benzimidazol-2- yl]oxy]-2-methyl-benzoic acid']"
46910592,methanesulfonic acid;4-[(4-methylpiperazin-1-yl)methyl]-N-[6-methyl-5-[(4-pyridin-3-ylpyrimidin-2-yl)amino]pyridin-3-yl]-3-(trifluoromethyl)benzamide,E73439,C30H33F3N8O4S,658.7,CC1=C(C=C(C=N1)NC(=O)C2=CC(=C(C=C2)CN3CCN(CC3)C)C(F)(F)F)NC4=NC=CC(=N4)C5=CN=CC=C5.CS(=O)(=O)O,"['Flumatinib mesylate', '895519-91-2', 'UNII-95Y8L63NBC', '95Y8L63NBC', 'HH-GV-678 mesylate', 'DTXSID70237780', 'FLUMATINIB MESYLATE [WHO-DD]', 'BENZAMIDE, 4-((4-METHYL-1-PIPERAZINYL)METHYL)-N-(6-METHYL-5-((4-(3-PYRIDINYL)-2-PYRIMIDINYL)AMINO)-3-PYRIDINYL)-3-(TRIFLUOROMETHYL)-, METHANESULFONATE (1:1)', 'BENZAMIDE, 4-((4-METHYL-1-PIPERAZINYL)METHYL)-N-(6-METHYL-5-((4-(3-PYRIDINYL)-2-PYRIMIDINYL)AMINO)-3-PYRIDINYL)-3-(TRIFLUOROMETHYL)-, MONOMETHANESULFONATE', '4-(4-Methyl-piperazin-1-ylmethyl)-N-(6-methyl-5-(4-pyridin-3-yl-pyrimidin-2-ylamino)-pyridin-3-yl)-3-trifluoromethyl-benzamide Mesylate']"
51039094,"6-N-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-4-N-[3-methyl-4-([1,2,4]triazolo[1,5-a]pyridin-7-yloxy)phenyl]quinazoline-4,6-diamine",Tukysa,C26H24N8O2,480.5,CC1=C(C=CC(=C1)NC2=NC=NC3=C2C=C(C=C3)NC4=NC(CO4)(C)C)OC5=CC6=NC=NN6C=C5,"['Tucatinib', 'Irbinitinib', 'Tukysa', 'ONT-380', 'Arry 380', 'N6-(4,4-Dimethyl-4,5-dihydrooxazol-2-yl)-N4-(3-methyl-4-((1,2,4)triazolo(1,5-a)pyridin-7-yloxy)phenyl)quinazoline-4,6-diamine', 'UNII-234248D0HH', 'ONT 380', '234248D0HH', '4,6-Quinazolinediamine, N6-(4,5-dihydro-4,4-dimethyl-2-oxazolyl)-N4-(3-methyl-4-((1,2,4)triazolo(1,5-a)pyridin-7-yloxy)phenyl)-']"
5583,"5-methyl-6-[(3,4,5-trimethoxyanilino)methyl]quinazoline-2,4-diamine",TMQ,C19H23N5O3,369.4,CC1=C(C=CC2=C1C(=NC(=N2)N)N)CNC3=CC(=C(C(=C3)OC)OC)OC,"['trimetrexate', '52128-35-5', 'Trimetrexato', 'Jb-11', 'Trimetrexatum [INN-Latin]', 'Trimetrexato [INN-Spanish]', 'Trimetrexatum', 'NSC-249008', 'JB 11', 'NSC 249008']"
11960271,"2-(5-fluoro-2-methyl-1H-indol-3-yl)-1H-imidazo[4,5-f][1,10]phenanthroline",s6963,C22H14FN5,367.4,CC1=C(C2=C(N1)C=CC(=C2)F)C3=NC4=C5C=CC=NC5=C6C(=C4N3)C=CC=N6,"['APTO-253', '916151-99-0', 'LOR-253', '2-(5-fluoro-2-methyl-1H-indol-3-yl)-1H-imidazo[4,5-f][1,10]phenanthroline', 'Lt-253(former code)', 'Lor-253(former code)', 'LT-253', 'WB59MRW00U', 'UNII-WB59MRW00U', '2-(5-Fluoro-2-methyl-1H-indol-3-yl)-1H-imidazo(4,5-F)(1,10)phenanthroline']"
11310,(4-acetyloxy-3-methylnaphthalen-1-yl) acetate,Kapilin,C15H14O4,258.27,CC1=C(C2=CC=CC=C2C(=C1)OC(=O)C)OC(=O)C,"['Acetomenaphthone', 'Menadiol diacetate', 'Kapilin', 'Adaprin', 'Kapilon', 'Kayvite', 'Pafavit', 'Prokayvit oral', 'Kativ powder', 'Davitamon-K']"
6918837,(E)-N-hydroxy-3-[4-[[2-(2-methyl-1H-indol-3-yl)ethylamino]methyl]phenyl]prop-2-enamide,Faridak,C21H23N3O2,349.4,CC1=C(C2=CC=CC=C2N1)CCNCC3=CC=C(C=C3)C=CC(=O)NO,"['Panobinostat', '404950-80-7', 'Faridak', 'UNII-9647FM7Y3Z', 'CHEBI:85990', '9647FM7Y3Z', '(2E)-N-hydroxy-3-[4-({[2-(2-methyl-1H-indol-3-yl)ethyl]amino}methyl)phenyl]prop-2-enamide', 'DTXSID40193506', '(2E)-N-hydroxy-3-[4-({[2-(2-methyl-1H-indol-3-yl)ethyl]amino}methyl)phenyl]acrylamide', 'PANOBINOSTAT (MART.)']"
104850,"5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl-N-piperidin-1-ylpyrazole-3-carboxamide",Zimulti,C22H21Cl3N4O,463.8,CC1=C(N(N=C1C(=O)NN2CCCCC2)C3=C(C=C(C=C3)Cl)Cl)C4=CC=C(C=C4)Cl,"['Rimonabant', '168273-06-1', 'Acomplia', 'Zimulti', '5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl-N-(piperidin-1-yl)-1H-pyrazole-3-carboxamide', 'SR141716', 'SR 141716', 'SR141716A', 'SR-141716A', 'Acomplia (TN)']"
104849,"5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl-N-piperidin-1-ylpyrazole-3-carboxamide;hydrochloride",A11475,C22H22Cl4N4O,500.2,CC1=C(N(N=C1C(=O)NN2CCCCC2)C3=C(C=C(C=C3)Cl)Cl)C4=CC=C(C=C4)Cl.Cl,"['Rimonabant hydrochloride', '158681-13-1', 'Rimonabant HCl', 'UNII-HL0V2LQZ09', 'HL0V2LQZ09', '5-(4-Chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl-N-1-piperidinyl-1H-pyrazole-3-carboxamide monohydrochloride', 'N-(Piperidin-1-yl)-5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl-1H-pyrazole-3-carboxamide hydrochloride', 'DTXSID20166495', 'RIMONABANT HYDROCHLORIDE [MI]', '1H-Pyrazole-3-carboxamide, 5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl-N-1-piperidinyl-, monohydrochloride']"
14296,"2,3,5,6-tetramethylpyrazine",TMPZ,C8H12N2,136.19,CC1=C(N=C(C(=N1)C)C)C,"['2,3,5,6-Tetramethylpyrazine', 'TETRAMETHYLPYRAZINE', '1124-11-4', 'Ligustrazine', 'Pyrazine, tetramethyl-', 'Bs factor', 'Tetrapyrazine', 'Tetramethylpyrazin', 'Chuanxiongzine', 'Liqustrazine']"
5344,"4-amino-N-(3,4-dimethyl-1,2-oxazol-5-yl)benzenesulfonamide",SOXO,C11H13N3O3S,267.31,CC1=C(ON=C1C)NS(=O)(=O)C2=CC=C(C=C2)N,"['sulfisoxazole', '127-69-5', 'Sulphafurazole', 'Sulfafurazol', 'Sulfisoxazol', 'Sulfaisoxazole', 'Sulfofurazole', 'Sulfisoxasole', 'Sulphaisoxazole', 'Sulfadimethylisoxazole']"
56649450,"(2S)-1-N-[4-methyl-5-[2-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridin-4-yl]-1,3-thiazol-2-yl]pyrrolidine-1,2-dicarboxamide",Piqray,C19H22F3N5O2S,441.5,CC1=C(SC(=N1)NC(=O)N2CCCC2C(=O)N)C3=CC(=NC=C3)C(C)(C)C(F)(F)F,"['alpelisib', '1217486-61-7', 'Vijoice', 'BYL 719', 'UNII-08W5N2C97Q', '08W5N2C97Q', '1,2-PYRROLIDINEDICARBOXAMIDE, N1-[4-METHYL-5-[2-(2,2,2-TRIFLUORO-1,1-DIMETHYLETHYL)-4-PYRIDINYL]-2-THIAZOLYL]-, (2S)-', '1,2-Pyrrolidinedicarboxamide, N1-(4-methyl-5-(2-(2,2,2-trifluoro-1,1-dimethylethyl)-4-pyridinyl)-2-thiazolyl)-, (2S)-', 'alpelisibum', '(2S)-N1-(4-METHYL-5-(1-(1,1,1-TRIFLUORO-2-METHYLPROPAN-2-YL)PYRIDIN-4-YL)-1,3-THIAZOL-2-YL)PYRROLIDINE-1,2-DICARBOXAMIDE']"
11707110,"N-[3-[3-cyclopropyl-5-(2-fluoro-4-iodoanilino)-6,8-dimethyl-2,4,7-trioxopyrido[4,3-d]pyrimidin-1-yl]phenyl]acetamide",QOM,C26H23FIN5O4,615.4,CC1=C2C(=C(N(C1=O)C)NC3=C(C=C(C=C3)I)F)C(=O)N(C(=O)N2C4=CC=CC(=C4)NC(=O)C)C5CC5,"['Trametinib', '871700-17-3', 'TMT212', 'trametinibum', 'UNII-33E86K87QN', 'CHEBI:75998', 'TMT-212', '33E86K87QN', 'MEK Inhibitor GSK1120212', 'L01XE25']"
4463,"2-cyclopropyl-7-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaen-10-one",NVP,C15H14N4O,266.30,CC1=C2C(=NC=C1)N(C3=C(C=CC=N3)C(=O)N2)C4CC4,"['nevirapine', '129618-40-2', 'Viramune', 'BI-RG-587', 'Nevirapine anhydrous', ""11-Cyclopropyl-4-methyl-5,11-dihydro-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepin-6-one"", 'Viramune XR', 'BIRG 0587', 'BIRG587', 'Nevirapine, anhydrous']"
118598754,"6-[(6-aminopyrimidin-4-yl)amino]-8-methylspiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione",Tomivosertib,C17H20N6O2,340.4,CC1=C2C(=O)NC3(N2C(=O)C(=C1)NC4=NC=NC(=C4)N)CCCCC3,"['Tomivosertib', 'eFT508', '1849590-01-7', 'EFT-508', 'Tomivosertib [INN]', 'Tomivosertib [USAN]', 'EFT 508', 'U2H19X4WBV', ""6-[(6-aminopyrimidin-4-yl)amino]-8-methylspiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione"", 'CHEMBL4073443']"
36314,"[(1S,2S,3R,4S,7R,9S,10S,12R,15S)-4,12-diacetyloxy-15-[(2R,3S)-3-benzamido-2-hydroxy-3-phenylpropanoyl]oxy-1,9-dihydroxy-10,14,17,17-tetramethyl-11-oxo-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate",Zisu,C47H51NO14,853.9,CC1=C2C(C(=O)C3(C(CC4C(C3C(C(C2(C)C)(CC1OC(=O)C(C(C5=CC=CC=C5)NC(=O)C6=CC=CC=C6)O)O)OC(=O)C7=CC=CC=C7)(CO4)OC(=O)C)O)C)OC(=O)C,"['paclitaxel', 'TAXOL', '33069-62-4', 'Taxol A', 'Yewtaxan', 'Genaxol', 'Plaxicel', 'Ebetaxel', 'Genetaxyl', 'Capxol']"
148124,"[(1S,2S,3R,4S,7R,9S,10S,12R,15S)-4-acetyloxy-1,9,12-trihydroxy-15-[(2R,3S)-2-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]oxy-10,14,17,17-tetramethyl-11-oxo-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate",TXL,C43H53NO14,807.9,CC1=C2C(C(=O)C3(C(CC4C(C3C(C(C2(C)C)(CC1OC(=O)C(C(C5=CC=CC=C5)NC(=O)OC(C)(C)C)O)O)OC(=O)C6=CC=CC=C6)(CO4)OC(=O)C)O)C)O,"['docetaxel', '114977-28-5', 'Taxotere', 'Docetaxel anhydrous', 'Docetaxel Winthrop', 'Docetaxol', 'Docetaxel Kabi', 'EmDOC', 'Docetaxolum', 'Docefrez']"
148123,"[(1S,2S,3R,4S,7R,9S,10S,12R,15S)-4-acetyloxy-1,9,12-trihydroxy-15-[(2R,3S)-2-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]oxy-10,14,17,17-tetramethyl-11-oxo-6-oxatetracyclo[11.3.1.03,10.04,7]heptadec-13-en-2-yl] benzoate;trihydrate",D02165,C43H59NO17,861.9,CC1=C2C(C(=O)C3(C(CC4C(C3C(C(C2(C)C)(CC1OC(=O)C(C(C5=CC=CC=C5)NC(=O)OC(C)(C)C)O)O)OC(=O)C6=CC=CC=C6)(CO4)OC(=O)C)O)C)O.O.O.O,"['Docetaxel trihydrate', '148408-66-6', 'Docetaxel hydrate', 'XRP6976', 'Docetaxel (Trihydrate)', 'Docetaxel (as trihydrate)', 'CHEBI:59809', '15H5577CQD', '148408-66-6 (hydrate)', 'Taxotere (TN)']"
11256664,2-[(4-hydroxy-1-methyl-7-phenoxyisoquinoline-3-carbonyl)amino]acetic acid,Evrenzo,C19H16N2O5,352.3,CC1=C2C=C(C=CC2=C(C(=N1)C(=O)NCC(=O)O)O)OC3=CC=CC=C3,"['Roxadustat', '808118-40-3', 'FG-4592', 'FG4592', 'ASP 1517', 'Roxadustat [USAN:INN]', 'ASP1517', 'X3O30D9YMX', 'roxadustatum', 'FG 4592']"
6989,5-methyl-2-propan-2-ylphenol,IPMP,C10H14O,150.22,CC1=CC(=C(C=C1)C(C)C)O,"['THYMOL', '89-83-8', '3-p-Cymenol', '6-Isopropyl-m-cresol', 'Thymic acid', '3-Hydroxy-p-cymene', '6-Isopropyl-3-methylphenol', 'Isopropyl cresol', 'm-Thymol', 'p-Cymene, 3-hydroxy-']"
3463,"5-(2,5-dimethylphenoxy)-2,2-dimethylpentanoic acid",Gemd,C15H22O3,250.33,CC1=CC(=C(C=C1)C)OCCCC(C)(C)C(=O)O,"['gemfibrozil', '25812-30-0', '5-(2,5-Dimethylphenoxy)-2,2-dimethylpentanoic acid', 'Lipur', 'Cholespid', 'Fibratol', 'Fibrocit', 'Gemfibril', 'Gemfibromax', 'Gemfibrozilo']"
9966051,"1-[2-(2,4-dimethylphenyl)sulfanylphenyl]piperazine",VTX,C18H22N2S,298.4,CC1=CC(=C(C=C1)SC2=CC=CC=C2N3CCNCC3)C,"['VORTIOXETINE', '508233-74-7', 'vortioxetina', 'vortioxetinum', 'UNII-3O2K1S3WQV', '3O2K1S3WQV', 'CHEBI:76016', 'Piperazine, 1-[2-[(2,4-dimethylphenyl)thio]phenyl]-', 'HSDB 8250', 'Piperazine, 1-(2-((2,4-dimethylphenyl)thio)phenyl)-']"
67448836,"9-[4-[(2R)-1-aminopropan-2-yl]phenyl]-8-hydroxy-6-methyl-5H-thieno[2,3-c]quinolin-4-one",OTS514,C21H20N2O2S,364.5,CC1=CC(=C(C2=C1NC(=O)C3=C2C=CS3)C4=CC=C(C=C4)C(C)CN)O,"['OTS514', '1338540-63-8', '(R)-9-(4-(1-aminopropan-2-yl)phenyl)-8-hydroxy-6-methylthieno[2,3-c]quinolin-4(5H)-one', 'OTS-514', '9-[4-[(2R)-1-aminopropan-2-yl]phenyl]-8-hydroxy-6-methyl-5H-thieno[2,3-c]quinolin-4-one', '9-[4-[(1R)-2-Amino-1-methylethyl]phenyl]-8-hydroxy-6-methylthieno[2,3-c]quinolin-4(5H)-one', 'C21H20N2O2S', '9-{4-[(2R)-1-aminopropan-2-yl]phenyl}-8-hydroxy-6-methyl-5H-thieno[2,3-c]quinolin-4-one', 'OTS514HCl', 'SCHEMBL2549909']"
129073603,N-[(1S)-1-[6-(4-fluoropyrazol-1-yl)pyridin-3-yl]ethyl]-1-methoxy-4-[4-methyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl]cyclohexane-1-carboxamide,Gavreto,C27H32FN9O2,533.6,CC1=CC(=NN1)NC2=NC(=NC(=C2)C)C3CCC(CC3)(C(=O)NC(C)C4=CN=C(C=C4)N5C=C(C=N5)F)OC,"['Pralsetinib', '2097132-94-8', 'BLU-667', 'Blu667', 'Gavreto', 'BLU123244', '1WPE73O1WV', 'X581238', 'BLU-123244', 'X-581238']"
4055,"2-methylnaphthalene-1,4-dione",MNQ,C11H8O2,172.18,CC1=CC(=O)C2=CC=CC=C2C1=O,"['menadione', '58-27-5', '2-Methyl-1,4-naphthoquinone', '2-methylnaphthalene-1,4-dione', 'Menaphthone', 'Kayquinone', '2-Methylnaphthoquinone', 'Thyloquinone', 'Kappaxin', 'Kayklot']"
2749,6-cyclohexyl-1-hydroxy-4-methylpyridin-2-one,Terit,C12H17NO2,207.27,CC1=CC(=O)N(C(=C1)C2CCCCC2)O,"['CICLOPIROX', '29342-05-0', 'HOE 296b', 'cyclopirox', 'Ciclopiroxum', '2(1H)-Pyridinone, 6-cyclohexyl-1-hydroxy-4-methyl-', 'Terit', 'HOE-296b', '6-cyclohexyl-1-hydroxy-4-methylpyridin-2(1H)-one', 'Ciclopirox gel']"
667493,6-methyl-2-sulfanylidene-1H-pyrimidin-4-one,MTU,C5H6N2OS,142.18,CC1=CC(=O)NC(=S)N1,"['methylthiouracil', '6-Methyl-2-thiouracil', '4-hydroxy-2-mercapto-6-methylpyrimidine', 'Thimecil', 'Metacil', 'Methacil', 'Thyreostat', '4(1H)-Pyrimidinone, 2,3-dihydro-6-methyl-2-thioxo-', 'Methyl thiouracil', 'Methacil (VAN)']"
4659569,"(3,4-dihydroxy-5-nitrophenyl)-(4-methylphenyl)methanone",TCW,C14H11NO5,273.24,CC1=CC=C(C=C1)C(=O)C2=CC(=C(C(=C2)O)O)[N+](=O)[O-],"['Tolcapone', '134308-13-7', ""3,4-Dihydroxy-4'-methyl-5-nitrobenzophenone"", '(3,4-Dihydroxy-5-nitrophenyl)(4-methylphenyl)methanone', 'UNII-CIF6334OLY', 'Methanone, (3,4-dihydroxy-5-nitrophenyl)(4-methylphenyl)-', 'CCRIS 7904', 'Tolcapona', 'CIF6334OLY', 'Ro-407592']"
5509,2-[1-methyl-5-(4-methylbenzoyl)pyrrol-2-yl]acetic acid,TLT,C15H15NO3,257.28,CC1=CC=C(C=C1)C(=O)C2=CC=C(N2C)CC(=O)O,"['tolmetin', '26171-23-3', '1-Methyl-5-p-toluoylpyrrole-2-acetic acid', 'Tolmetine', 'Tolmetina', 'Tolmetinum', '1H-Pyrrole-2-acetic acid, 1-methyl-5-(4-methylbenzoyl)-', 'Tolmetino', 'Tolmetine [INN-French]', 'Tolmetinum [INN-Latin]']"
2662,4-[5-(4-methylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide,ELYXYB,C17H14F3N3O2S,381.4,CC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F,"['celecoxib', '169590-42-5', 'Celebra', 'Onsenal', 'Celecox', '184007-95-2', 'Xilebao', 'YM177', 'YM 177', 'HSDB 7038']"
9875462,"[(3S)-3-amino-3-carboxypropyl]-[[(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl]-methylsulfanium;hydrogen sulfate;4-methylbenzenesulfonic acid;sulfuric acid",DS-15934,C22H34N6O16S4,766.8,CC1=CC=C(C=C1)S(=O)(=O)O.C[S+](CCC(C(=O)O)N)CC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)O.OS(=O)(=O)O.OS(=O)(=O)[O-],"['S-Adenosyl-L-methionine (disulfate tosylate)', '((S)-3-Amino-3-carboxypropyl)(((2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl)(methyl)sulfonium hydrogen sulfate 4-methylbenzenesulfonate sulfate', 'MFCD01674068', 'HY-W017770R', 'CS-W018556', 'HY-W017770', 'DS-15934', 'S-Adenosyl-L-methionine disulfate tosylate USP grade', 'S-Adenosyl-L-methionine (disulfate tosylate) (Standard)', ""Adenosine,5'-[[(3S)-3-amino-3-carboxypropyl]methylsulfonio]-5'-deoxy-, sulfate(salt), 4-methylbenzenesulfonate (salt) sulfate (salt) (1:1:1:1)""]"
11557040,N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-[5-[(2-methylsulfonylethylamino)methyl]furan-2-yl]quinazolin-4-amine;4-methylbenzenesulfonic acid;hydrate,Tyverb,C43H44ClFN4O11S3,943.5,CC1=CC=C(C=C1)S(=O)(=O)O.CC1=CC=C(C=C1)S(=O)(=O)O.CS(=O)(=O)CCNCC1=CC=C(O1)C2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)OCC5=CC(=CC=C5)F)Cl.O,"['Tyverb', 'Tycerb', 'GW572016F', 'GW-572016F', 'UNII-G873GX646R', 'G873GX646R', 'Lapatinib ditoluenesulfonate monohydrate', 'Lapatinib ditosylate anhydrous', 'LAPATINIB TOSILATE (MART.)', 'LAPATINIB TOSILATE [MART.]']"
46205871,"4-[4-[4-[4-fluoro-3-(trifluoromethyl)phenyl]-1-methylimidazol-2-yl]piperidin-1-yl]-1H-pyrazolo[3,4-d]pyrimidine;4-methylbenzenesulfonic acid",s7704,C28H27F4N7O3S,617.6,CC1=CC=C(C=C1)S(=O)(=O)O.CN1C=C(N=C1C2CCN(CC2)C3=NC=NC4=C3C=NN4)C5=CC(=C(C=C5)F)C(F)(F)F,"['1082949-68-5', 'LY2584702 tosylate', 'LY-2584702 (tosylate salt)', 'LY-2584702 tosylate salt', 'LY 2584702 tosylate', '4-(4-(4-(4-fluoro-3-(trifluoromethyl)phenyl)-1-methyl-1H-imidazol-2-yl)piperidin-1-yl)-1H-pyrazolo[3,4-d]pyrimidine 4-methylbenzenesulfonate', '4-[4-[4-[4-fluoro-3-(trifluoromethyl)phenyl]-1-methylimidazol-2-yl]piperidin-1-yl]-1H-pyrazolo[3,4-d]pyrimidine;4-methylbenzenesulfonic acid', '4-{4-[4-(4-fluoro-3-trifluoromethyl-phenyl)-1-methyl-1H-imidazol-2-yl]-piperidin-1-yl}-1H-pyrazolo[3,4-d]pyrimidine p-toluenesulfonate', '1H-Pyrazolo[3,4-d]pyrimidine, 4-[4-[4-[4-fluoro-3-(trifluoromethyl)phenyl]-1-methyl-1H-imidazol-2-yl]-1-piperidinyl]-, 4-methylbenzenesulfonate (1:1);LY2584702', 'LYS6K2 tosylate']"
25022378,"N'-(5-chloropyridin-2-yl)-N-[(1S,2R,4S)-4-(dimethylcarbamoyl)-2-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-2-carbonyl)amino]cyclohexyl]oxamide;4-methylbenzenesulfonic acid;hydrate",Lixiana,C31H40ClN7O8S2,738.3,CC1=CC=C(C=C1)S(=O)(=O)O.CN1CCC2=C(C1)SC(=N2)C(=O)NC3CC(CCC3NC(=O)C(=O)NC4=NC=C(C=C4)Cl)C(=O)N(C)C.O,"['1229194-11-9', 'edoxaban tosylate hydrate', 'Edoxaban tosylate monohydrate', 'Lixiana', 'SAVAYSA', 'Edoxaban tosilate monohydrate', 'Edoxaban tosilate hydrate', 'UNII-972203R4EW', 'Savaysa (TN)', '972203R4EW']"
44241743,"1-(4-fluorophenyl)-4-[(10R,15S)-4-methyl-1,4,12-triazatetracyclo[7.6.1.05,16.010,15]hexadeca-5,7,9(16)-trien-12-yl]butan-1-one;4-methylbenzenesulfonic acid",Caplyta,C31H36FN3O4S,565.7,CC1=CC=C(C=C1)S(=O)(=O)O.CN1CCN2C3CCN(CC3C4=C2C1=CC=C4)CCCC(=O)C5=CC=C(C=C5)F,"['lumateperone Tosylate', '1187020-80-9', 'ITI-007 tosylate', 'ITI 007', 'UNII-JIE88N006O', 'JIE88N006O', 'ITI007', ""1-(4-FLUOROPHENYL)-4-((6BR,10AS)-3-METHYL-2,3,6B,9,10,10A-HEXAHYDRO-1H-PYRIDO(3',4':4,5)PYRROLO(1,2,3-DE)QUINOXALIN-8(7H)-YL)BUTAN-1-ONE 4-METHYLBENZENESULFONATE (1:1)"", ""1-(4-fluorophenyl)-4-[(6bR,10aS)-3-methyl-2,3,6b,9,10,10a-hexahydro-1H-pyrido[3',4':4,5]pyrrolo[1,2,3-de]quinoxalin-8(7H)-yl]butan-1-one 4-methylbenzenesulfonate (1:1)"", ""1-BUTANONE, 1-(4-FLUOROPHENYL)-4-((6BR,10AS)-2,3,6B,9,10,10A-HEXAHYDRO-3-METHYL-1H-PYRIDO(3',4':4,5)PYRROLO(1,2,3-DE)QUINOXALIN-8(7H)-YL)-, 4-METHYLBENZENESULFONATE (1:1)""]"
119369,"N-[4-[5-(dimethylamino)-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl]phenyl]-2-methylbenzamide",Mozavaptan,C27H29N3O2,427.5,CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C(=O)N3CCCC(C4=CC=CC=C43)N(C)C,"['Mozavaptan', 'Mozavaptan [INN]', 'Opc 31260', 'Mozavaptane', 'OPC31260', 'DTXSID8057641', 'UNII-17OJ42922Y', 'MOZAVAPTAN [MI]', '17OJ42922Y', 'MOZAVAPTAN [MART.]']"
82146,"4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]benzoic acid",Targret,C24H28O2,348.5,CC1=CC2=C(C=C1C(=C)C3=CC=C(C=C3)C(=O)O)C(CCC2(C)C)(C)C,"['Bexarotene', '153559-49-0', 'Targrexin', 'Targretyn', 'Targret', 'bexaroteno', 'bexarotenum', 'LG100069', 'DTXSID1040619', 'LG 1069']"
52920501,N-[2-(dimethylamino)ethyl]-1-[3-[[4-[(2-methyl-1H-indol-5-yl)oxy]pyrimidin-2-yl]amino]phenyl]methanesulfonamide,UKI,C24H28N6O3S,480.6,CC1=CC2=C(N1)C=CC(=C2)OC3=NC(=NC=C3)NC4=CC=CC(=C4)CS(=O)(=O)NCCN(C)C,"['Sulfatinib', 'surufatinib', 'N-(2-(dimethylamino)ethyl)-1-(3-((4-((2-methyl-1H-indol-5-yl)oxy)pyrimidin-2-yl)amino)phenyl)methanesulfonamide', 'Surufatinib [INN]', 'Surufatinib [USAN]', 'HMPL012', 'Sulanda', 'KDR-IN-1', 'Sulfatinib [WHO-DD]', 'UNII-B2K5L1L8S9']"
135398745,"2-methyl-4-(4-methylpiperazin-1-yl)-10H-thieno[2,3-b][1,5]benzodiazepine",Midax,C17H20N4S,312.4,CC1=CC2=C(S1)NC3=CC=CC=C3N=C2N4CCN(CC4)C,"['olanzapine', '132539-06-1', 'Olansek', 'Zalasta', 'Zyprexa Zydis', 'Zyprexa Velotab', 'Zyprexa Intramuscular', 'olanzapina', 'Olanzapine Mylan', 'LY-170053']"
135151360,"7-methyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)amino]-9-(oxan-4-yl)purin-8-one",s8843,C18H20N8O2,380.4,CC1=CC2=NC=NN2C=C1NC3=NC=C4C(=N3)N(C(=O)N4C)C5CCOCC5,"['AZD-7648', 'AZD7648', '7-methyl-2-[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl)amino]-9-(oxan-4-yl)purin-8-one', 'compound 16 [PMID: 31851518]', 'compound 16 (PMID: 31851518)', '7-METHYL-2-((7-METHYL(1,2,4)TRIAZOLO(1,5-A)PYRIDIN-6-YL)AMINO)-9-(TETRAHYDRO-2H-PYRAN-4-YL)-7,9-DIHYDRO-8H-PURIN-8-ONE', '7-methyl-2-((7-methyl-(1,2,4)triazolo(1,5-a)pyridin-6-yl)amino)-9-(oxan-4-yl)purin-8-one', '7-methyl-2-({7-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-yl}amino)-9-(oxan-4-yl)purin-8-one', '7-Methyl-2-[(7-methyl[1,2,4]triazolo[1,5-a]pyridin-6-yl)amino]-9-(tetrahydro-2H-pyran-4-yl)-7,9-dihydro-8H-purin-8-one', 'DNA-PK inhibitor AZD7648']"
19090,"(8R,9S,10R,13S,14S,17R)-17-acetyl-17-hydroxy-6,10,13-trimethyl-2,8,9,11,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthren-3-one",Chronopil,C22H30O3,342.5,CC1=CC2C(CCC3(C2CCC3(C(=O)C)O)C)C4(C1=CC(=O)CC4)C,"['megestrol', '3562-63-8', 'Megestrolo', 'Pregna-4,6-diene-3,20-dione, 17-hydroxy-6-methyl-', 'Chronopil', 'Megestrolum', '17-Hydroxy-6-methylpregna-4,6-diene-3,20-dione', 'Megestrolum [INN-Latin]', 'HSDB 3233', 'UNII-EA6LD1M70M']"
12108541,"sodium;5-methoxy-2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methylsulfinyl]benzimidazol-3-ide",FO67914,C17H18N3NaO3S,367.4,CC1=CN=C(C(=C1OC)C)CS(=O)C2=NC3=C([N-]2)C=C(C=C3)OC.[Na+],"['Omeprazole (sodium)', 'MFCD07802816', '161796-78-7', '1H-Benzimidazole,5-methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]sulfinyl]-,sodium salt', 'Sodium (R)-6-methoxy-2-(((4-methoxy-3,5-dimethylpyridin-2-yl)methyl)sulfinyl)benzo[d]imidazol-1-ide', 'Sodium 6-methoxy-2-(((4-methoxy-3,5-dimethylpyridin-2-yl)methyl)sulfinyl)benzo[d]imidazol-1-ide', 'MFCD19705377', 'H 168 68; Prilosec', 'Omeprazole sodium salt hydrate', 'HY-B0113A']"
4594,"6-methoxy-2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methylsulfinyl]-1H-benzimidazole",OMZ,C17H19N3O3S,345.4,CC1=CN=C(C(=C1OC)C)CS(=O)C2=NC3=C(N2)C=C(C=C3)OC,"['omeprazole', '73590-58-6', 'Losec', 'Antra', 'Audazol', 'Omeprazon', 'Mopral', 'Omapren', 'Parizac', 'Ceprandal']"
67517580,N-tert-butyl-3-[[5-methyl-2-[4-(2-pyrrolidin-1-ylethoxy)anilino]pyrimidin-4-yl]amino]benzenesulfonamide;hydrate;dihydrochloride,Inrebic,C27H40Cl2N6O4S,615.6,CC1=CN=C(N=C1NC2=CC(=CC=C2)S(=O)(=O)NC(C)(C)C)NC3=CC=C(C=C3)OCCN4CCCC4.O.Cl.Cl,"['1374744-69-0', 'fedratinib hydrochloride', 'Fedratinib dihydrochloride monohydrate', 'UH9J2HBQWJ', 'SAR302503A', 'UNII-UH9J2HBQWJ', 'N-tert-Butyl-3-((5-methyl-2-((4-(2-pyrrolidin-1-ylethoxy)phenyl)amino)pyrimidin-4-yl)amino) benzenesulfonamide dihydrochloride monohydrate', 'BENZENESULFONAMIDE, N-(1,1-DIMETHYLETHYL)-3-((5-METHYL-2-((4-(2-(1-PYRROLIDINYL)ETHOXY)PHENYL)AMINO)-4-PYRIMIDINYL)AMINO)-, HYDROCHLORIDE, HYDRATE (1:2:1)', 'fedratinib hydrochloride monohydrate', 'Fedratinib (hydrochloride hydrate)']"
54677470,"4-hydroxy-2-methyl-N-(5-methyl-1,3-thiazol-2-yl)-1,1-dioxo-1lambda6,2-benzothiazine-3-carboxamide",Mobec,C14H13N3O4S2,351.4,CC1=CN=C(S1)NC(=O)C2=C(C3=CC=CC=C3S(=O)(=O)N2C)O,"['meloxicam', '71125-38-7', 'Metacam', 'Movatec', 'Mobec', 'Mobicox', 'Coxicam', 'Meloxivet', 'Melfax', 'UH-AC 62XX']"
1054,"4,5-bis(hydroxymethyl)-2-methylpyridin-3-ol",PN,C8H11NO3,169.18,CC1=NC=C(C(=C1O)CO)CO,"['pyridoxine', '65-23-6', 'Pyridoxol', 'Pyridoxin', '3-hydroxy-4,5-bis(hydroxymethyl)-2-methylpyridine', 'Pyridoxolum', '5-Hydroxy-6-methyl-3,4-pyridinedimethanol', 'Piridoxina', 'Pyridoxinum', 'Piridossina']"
6019,"4,5-bis(hydroxymethyl)-2-methylpyridin-3-ol;hydrochloride",Pydox,C8H12ClNO3,205.64,CC1=NC=C(C(=C1O)CO)CO.Cl,"['PYRIDOXINE HYDROCHLORIDE', '58-56-0', 'Pyridoxol hydrochloride', 'Hexa-Betalin', 'Aderoxine', 'Alestrol', 'Bonasanit', 'Hexavibex', 'Hexermin', 'Hexobion']"
28061,1-chloro-3-(2-methyl-5-nitroimidazol-1-yl)propan-2-ol,Tiberal,C7H10ClN3O3,219.62,CC1=NC=C(N1CC(CCl)O)[N+](=O)[O-],"['Ornidazole', '16773-42-5', 'Tiberal', 'Ro 7-0207', 'Madelen', 'Ornidazol', 'Ornidazolum', '1-chloro-3-(2-methyl-5-nitro-1H-imidazol-1-yl)propan-2-ol', '1-(3-Chloro-2-hydroxypropyl)-2-methyl-5-nitroimidazole', 'Ornidal']"
135400182,(2S)-2-[[5-[methyl-[(2-methyl-4-oxo-3H-quinazolin-6-yl)methyl]amino]thiophene-2-carbonyl]amino]pentanedioic acid,Tomudex,C21H22N4O6S,458.5,CC1=NC2=C(C=C(C=C2)CN(C)C3=CC=C(S3)C(=O)NC(CCC(=O)O)C(=O)O)C(=O)N1,"['Raltitrexed', 'Tomudex', '112887-68-0', 'ZD1694', 'ZD-1694', 'ICI-D1694', 'D-1694', 'ICI D1694', 'ZD-16', 'D1694']"
138911318,N-[(1R)-1-[3-amino-5-(trifluoromethyl)phenyl]ethyl]-7-methoxy-2-methyl-6-[(3S)-oxolan-3-yl]oxyquinazolin-4-amine,L7H,C23H25F3N4O3,462.5,CC1=NC2=CC(=C(C=C2C(=N1)NC(C)C3=CC(=CC(=C3)N)C(F)(F)F)OC4CCOC4)OC,"['BI-3406', 'N-((R)-1-(3-amino-5-(trifluoromethyl)phenyl)ethyl)-7-methoxy-2-methyl-6-(((S)-tetrahydrofuran-3-yl)oxy)quinazolin-4-amine', 'BI3406', 'N-[(1R)-1-[3-amino-5-(trifluoromethyl)phenyl]ethyl]-7-methoxy-2-methyl-6-[(3S)-oxolan-3-yl]oxyquinazolin-4-amine', 'N-((1R)-1-(3-amino-5-(trifluoromethyl)phenyl)ethyl)-7-methoxy-2-methyl-6-((3S)-oxolan-3-yl)oxyquinazolin-4-amine', 'N-[(R)-1-[3-Amino-5-(trifluoromethyl)phenyl]ethyl]-7-methoxy-2-methyl-6-[[(S)-tetrahydrofuran-3-yl]oxy]quinazolin-4-amine', '2230836-55-0', 'N-[(1R)-1-[3-amino-5-(trifluoromethyl)phenyl]ethyl]-7-methoxy-2-methyl-6-[(3S)-tetrahydrofuran-3-yl]oxy-quinazolin-4-amine', 'CHEMBL4519023', 'MFCD32197204']"
31307,"(8S,9R,10S,11S,13S,14S,16R,17S)-9-fluoro-11,16,17-trihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one",Volon,C21H27FO6,394.4,CC12CC(C3(C(C1CC(C2(C(=O)CO)O)O)CCC4=CC(=O)C=CC43C)F)O,"['triamcinolone', '124-94-7', 'Fluoxyprednisolone', 'Triamcinolon', 'Rodinolone', 'Delphicort', 'Ledercort', 'Tricortale', 'Adcortyl', 'Celeste']"
68873,"(1R,2R,4R,10R,11S,14S,15S,16S,18S,19S)-10,14-dimethylspiro[hexacyclo[9.8.0.02,4.05,10.014,19.016,18]nonadec-5-ene-15,5'-oxolane]-2',7-dione",DRSP,C24H30O3,366.5,CC12CCC(=O)C=C1C3CC3C4C2CCC5(C4C6CC6C57CCC(=O)O7)C,"['Drospirenone', '67392-87-4', 'Dihydrospirorenone', 'Dehydrospirorenone', 'Drospirenona', '1,2-Dihydrospirorenone', 'DRSP', 'Drospirenonum', 'Drospirenonum [INN-Latin]', 'Drospirenona [INN-Spanish]']"
443872,"methyl (1R,2S,9R,10R,11S,14R,15S,17R)-2,15-dimethyl-5,5'-dioxospiro[18-oxapentacyclo[8.8.0.01,17.02,7.011,15]octadec-6-ene-14,2'-oxolane]-9-carboxylate",YNU,C24H30O6,414.5,CC12CCC(=O)C=C1CC(C3C24C(O4)CC5(C3CCC56CCC(=O)O6)C)C(=O)OC,"['Eplerenone', 'Selara', 'SC-66110', 'CGP-30083', 'Eplerenona', 'Cgp 30083', 'HSDB 7522', 'DTXSID2046094', 'UNII-6995V82D0B', 'CHEBI:31547']"
9046,"(8R,9S,13S,14S,17R)-3-cyclopentyloxy-17-ethynyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-ol",Eston,C25H32O2,364.5,CC12CCC3C(C1CCC2(C#C)O)CCC4=C3C=CC(=C4)OC5CCCC5,"['QUINESTROL', '152-43-2', 'Estrovister', 'Plestrovis', 'Eston', 'Estradiol-17-beta 3-cyclopentyl ether', 'Qui-Lea', 'Quinestrolum', 'EECPE', 'Estrovis 4000']"
23674502,"potassium;[(8R,9S,13S,14S)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] sulfate",G12139,C18H21KO5S,388.5,CC12CCC3C(C1CCC2=O)CCC4=C3C=CC(=C4)OS(=O)(=O)[O-].[K+],"['potassium estrone sulfate', '1240-04-6', 'UNII-C354LET0O4', 'EINECS 214-985-1', 'NSC 18054', 'NSC-18054', 'estrone sulfate, potassium salt', '214-985-1', 'Estrone sulfate (potassium)', 'MLS000028631']"
57363,"(1S,3aS,3bS,5aR,9aR,9bS,11aS)-N-tert-butyl-9a,11a-dimethyl-7-oxo-1,2,3,3a,3b,4,5,5a,6,9b,10,11-dodecahydroindeno[5,4-f]quinoline-1-carboxamide",Proscar,C23H36N2O2,372.5,CC12CCC3C(C1CCC2C(=O)NC(C)(C)C)CCC4C3(C=CC(=O)N4)C,"['finasteride', '98319-26-7', 'Finastid', 'Prostide', 'Finasterida', 'Finpecia', 'Finasteridum', 'Finasteridum [INN-Latin]', 'Finasterida [INN-Spanish]', 'CCRIS 7438']"
104741,"(7R,8R,9S,13S,14S,17S)-13-methyl-7-[9-(4,4,5,5,5-pentafluoropentylsulfinyl)nonyl]-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol",Faslodex,C32H47F5O3S,606.8,CC12CCC3C(C1CCC2O)C(CC4=C3C=CC(=C4)O)CCCCCCCCCS(=O)CCCC(C(F)(F)F)(F)F,"['Fulvestrant', '129453-61-8', 'ZD-9238', 'fulvestrantum', 'ZD9238', 'UNII-22X328QOC4', 'CCRIS 8741', 'Faslodex(ICI 182,780)', 'DTXSID4022369', 'CHEBI:31638']"
9415,"(1R,4R,5R,6R,16R)-5,6-dihydroxy-4,5,6-trimethyl-2,8-dioxa-13-azatricyclo[8.5.1.013,16]hexadec-10-ene-3,7-dione",Crotaline,C16H23NO6,325.36,CC1C(=O)OC2CCN3C2C(=CC3)COC(=O)C(C1(C)O)(C)O,"['monocrotaline', '315-22-0', 'Monocrotalin', '(-)-Monocrotaline', 'NCI-C56462', 'CCRIS 416', 'CHEBI:6980', 'HSDB 3513', 'A 6080', 'Retronecine cyclic 2,3-dihydroxy-2,3,4-trimethylglutarate']"
6364534,"3-[(1R,3S,5S,8R,9S,10R,11R,13R,14S,17R)-1,5,11,14-tetrahydroxy-10-(hydroxymethyl)-13-methyl-3-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2H-furan-5-one;octahydrate",Strophoperm,C29H60O20,728.8,CC1C(C(C(C(O1)OC2CC(C3(C4C(CCC3(C2)O)C5(CCC(C5(CC4O)C)C6=CC(=O)OC6)O)CO)O)O)O)O.O.O.O.O.O.O.O.O,"['Ouabain octahydrate', '11018-89-6', 'Quabain octahydrate', 'Purostrophan', 'Strophoperm', 'Ouabain [USP]', 'Acocantherin octahydrate', 'UNII-1K0J875G48', '1K0J875G48', 'NSC-757425']"
16218542,"2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one;trihydrate",D00190,C27H36O19,664.6,CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)O)O)O)O)O)O)O.O.O.O,"['Rutin trihydrate', '250249-75-3', 'Rutoside trihydrate', 'Rutoside trihydrate [EP]', 'RF4N03853G', 'DTXSID50179735', 'RUTOSIDE TRIHYDRATE [WHO-DD]', 'RUTOSIDE TRIHYDRATE [EP MONOGRAPH]', '4H-1-Benzopyran-4-one, 3-((6-O-(6-deoxy-alpha-l-mannopyranosyl)-beta-D-glucopyranosyl)oxy)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-, trihydrate', '4H-1-BENZOPYRAN-4-ONE, 3-((6-O-(6-DEOXY-.ALPHA.-L-MANNOPYRANOSYL)-.BETA.-D-GLUCOPYRANOSYL)OXY)-2-(3,4-DIHYDROXYPHENYL)-5,7-DIHYDROXY-, TRIHYDRATE']"
10621,"(2S)-5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-2,3-dihydrochromen-4-one",Ciratin,C28H34O15,610.6,CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=CC(=C4C(=O)CC(OC4=C3)C5=CC(=C(C=C5)OC)O)O)O)O)O)O)O)O,"['hesperidin', '520-26-3', 'Cirantin', 'Hesperidoside', 'Hesper bitabs', 'Hesperetin 7-rhamnoglucoside', 'Hesperetin-rutinosid', 'Hesperidine', 'Hesperetin 7-rutinoside', 'Ciratin']"
441207,"3-[(3S,5R,8R,9S,10S,13R,14S,17R)-3-[(2R,4S,5S,6R)-5-[(2S,4S,5S,6R)-5-[(2S,4S,5S,6R)-4,5-dihydroxy-6-methyloxan-2-yl]oxy-4-hydroxy-6-methyloxan-2-yl]oxy-4-hydroxy-6-methyloxan-2-yl]oxy-14-hydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one",Digicor,C41H64O13,764.9,CC1C(C(CC(O1)OC2C(OC(CC2O)OC3C(OC(CC3O)OC4CCC5(C(C4)CCC6C5CCC7(C6(CCC7C8=CC(=O)OC8)O)C)C)C)C)O)O,"['digitoxin', '71-63-6', 'Digitoxoside', 'Crystodigin', 'Digitoxinum', 'Unidigin', 'Digitophyllin', 'Carditoxin', 'Cristapurat', 'Digitoksin']"
443939,"(7S,9S)-7-[(2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-9-(2-hydroxyacetyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione;hydrochloride",DOX,C27H30ClNO11,580.0,CC1C(C(CC(O1)OC2CC(CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(C(=O)CO)O)N)O.Cl,"['Doxorubicin Hydrochloride', '25316-40-9', 'Doxorubicin HCl', 'Adriacin', 'ADRIAMYCIN HYDROCHLORIDE', 'Hydroxydaunorubicin hydrochloride', 'Adriamycin PFS', 'Adriamycin RDF', 'ADRIAMYCIN, HYDROCHLORIDE', 'Adrosal']"
65348,"(7S,9S)-7-[(2R,4S,5R,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-9-(2-hydroxyacetyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione;hydrochloride",Ellence,C27H30ClNO11,580.0,CC1C(C(CC(O1)OC2CC(CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(C(=O)CO)O)N)O.Cl,"['Epirubicin hydrochloride', '56390-09-1', 'Epirubicin HCl', 'Epirubitec', 'Epidoxorubicin hydrochloride', 'CCRIS 4477', ""4'-Epidoxorubicin hydrochloride"", ""4'-epi-Adriamycin hydrochloride"", 'EINECS 260-145-2', 'NSC-759195']"
636362,"(7S,9S)-9-acetyl-7-[(2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-8,10-dihydro-7H-tetracene-5,12-dione;hydrochloride",DMDR,C26H28ClNO9,534.0,CC1C(C(CC(O1)OC2CC(CC3=C2C(=C4C(=C3O)C(=O)C5=CC=CC=C5C4=O)O)(C(=O)C)O)N)O.Cl,"['idarubicin hydrochloride', 'Idarubicin Hcl', '57852-57-0', 'Idamycin', 'Idamycin PFS', 'UNII-5VV3MDU5IE', '5VV3MDU5IE', 'Idarubicin hydrochloride PFS', 'DTXSID0047797', 'EINECS 260-990-7']"
163659,"(2S,3S)-2-[(2S,4R,5R,6R)-4-[(2S,4R,5S,6R)-4-[(2S,4S,5R,6R)-4,5-dihydroxy-4,6-dimethyloxan-2-yl]oxy-5-hydroxy-6-methyloxan-2-yl]oxy-5-hydroxy-6-methyloxan-2-yl]oxy-3-[(1S,3S,4R)-3,4-dihydroxy-1-methoxy-2-oxopentyl]-6-[(2S,4R,5R,6R)-4-[(2S,4R,5S,6R)-4,5-dihydroxy-6-methyloxan-2-yl]oxy-5-hydroxy-6-methyloxan-2-yl]oxy-8,9-dihydroxy-7-methyl-3,4-dihydro-2H-anthracen-1-one",Mithracin,C52H76O24,1085.1,CC1C(C(CC(O1)OC2CC(OC(C2O)C)OC3=CC4=CC5=C(C(=O)C(C(C5)C(C(=O)C(C(C)O)O)OC)OC6CC(C(C(O6)C)O)OC7CC(C(C(O7)C)O)OC8CC(C(C(O8)C)O)(C)O)C(=C4C(=C3C)O)O)O)O,"['plicamycin', 'MITHRAMYCIN', 'Mithracin', 'Aureolic acid', '18378-89-7', 'Mithramycine', 'Plicamycinum', 'Plicamycine', 'Mitramycin', 'Plicamycine [French]']"
6436173,"[(7S,9E,11S,12R,13S,14R,15R,16R,17S,18S,19E,21Z)-2,15,17,36-tetrahydroxy-11-methoxy-3,7,12,14,16,18,22,30-octamethyl-6,23-dioxo-8,37-dioxa-24,27,33-triazahexacyclo[23.10.1.14,7.05,35.026,34.027,32]heptatriaconta-1(35),2,4,9,19,21,25(36),26(34),28,30,32-undecaen-13-yl] acetate",Normix,C43H51N3O11,785.9,CC1C=CC=C(C(=O)NC2=C(C3=C(C4=C(C(=C3O)C)OC(C4=O)(OC=CC(C(C(C(C(C(C1O)C)O)C)OC(=O)C)C)OC)C)C5=C2N6C=CC(=CC6=N5)C)O)C,"['Rifaximin', 'Rifaxidin', '80621-81-4', 'Rifacol', 'Rifamycin L 105', 'Rifaximine', 'Fatroximin', 'Rifamixin', 'Rifaximina', 'Normix']"
54684461,"(4S,4aR,5S,5aR,6R,12aR)-4-(dimethylamino)-1,5,10,11,12a-pentahydroxy-6-methyl-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;hydrate",Adoxa,C22H26N2O9,462.4,CC1C2C(C3C(C(=O)C(=C(C3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)N)N(C)C)O.O,"['Invertin', 'DOXYCYCLINE MONOHYDRATE', '17086-28-1', 'Doxycycline hydrate', 'Adoxa', 'Xyrosa', 'Doxycycline (monohydrate)', 'Vibramycin', 'MFCD02682958', '2-Naphthacenecarboxamide,4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,5,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-, monohydrate,[4S-(4a,4aa,5a,5aa,6a,12aa)]-']"
3000226,"(2Z)-2-[(3R,4S,5S,8S,9S,10S,11R,13R,14S,16S)-16-acetyloxy-3,11-dihydroxy-4,8,10,14-tetramethyl-2,3,4,5,6,7,9,11,12,13,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-ylidene]-6-methylhept-5-enoic acid",Taksta,C31H48O6,516.7,CC1C2CCC3(C(C2(CCC1O)C)C(CC4C3(CC(C4=C(CCC=C(C)C)C(=O)O)OC(=O)C)C)O)C,"['fusidic acid', 'Fusidine', '6990-06-3', 'Ramycin', 'Fucidic acid', 'Fucidin acid', 'Flucidin', 'Taksta', 'Acide fusidique', 'Acido fusidico']"
24788740,"(2S)-2-(4-chlorophenyl)-1-[4-[(5R,7R)-7-hydroxy-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]piperazin-1-yl]-3-(propan-2-ylamino)propan-1-one",Ipatasertib,C24H32ClN5O2,458.0,CC1CC(C2=C1C(=NC=N2)N3CCN(CC3)C(=O)C(CNC(C)C)C4=CC=C(C=C4)Cl)O,"['Ipatasertib', '1001264-89-6', 'GDC-0068', 'RG7440', '(S)-2-(4-chlorophenyl)-1-(4-((5R,7R)-7-hydroxy-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)piperazin-1-yl)-3-(isopropylamino)propan-1-one', 'Ipatasertib [INN]', 'RG-7440', 'GDC0068', 'Ipatasertib [USAN:INN]', '524Y3IB4HQ']"
6279,"[(6S,8R,9S,10R,13S,14S,17R)-17-acetyl-6,10,13-trimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] acetate",Amen,C24H34O4,386.5,CC1CC2C(CCC3(C2CCC3(C(=O)C)OC(=O)C)C)C4(C1=CC(=O)CC4)C,"['Medroxyprogesterone acetate', '71-58-9', 'Medroxyprogesterone 17-acetate', 'Provera', 'Depo-Provera', 'Metigestrona', 'Gestapuran', 'Perlutex', 'Veramix', 'Methylacetoxyprogesterone']"
16923,"4-[2-[(6S,8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-6,10,13-trimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethoxy]-4-oxobutanoic acid",s6588,C26H34O8,474.5,CC1CC2C3CCC(C3(CC(C2C4(C1=CC(=O)C=C4)C)O)C)(C(=O)COC(=O)CCC(=O)O)O,"['METHYLPREDNISOLONE HEMISUCCINATE', '2921-57-5', 'Methylprednisolone succinate', 'Methylprednisolone hydrogen succinate', 'EINECS 220-863-9', 'Methylprednisolone Hemisuccinate [USP]', 'Methylprednisolone sodium hemisuccinate', 'EC 220-863-9', 'Methylprednisolone succinate (JP17)', '6-methylprednisolone-21-hemisuccinate']"
5743,"(8S,9R,10S,11S,13S,14S,16R,17R)-9-fluoro-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one",Dxms,C22H29FO5,392.5,CC1CC2C3CCC4=CC(=O)C=CC4(C3(C(CC2(C1(C(=O)CO)O)C)O)F)C,"['dexamethasone', '50-02-2', 'Hexadecadrol', 'Aeroseb-Dex', 'Fluormethylprednisolone', 'Desametasone', 'Superprednol', 'Visumetazone', 'Cortisumman', 'Decaderm']"
3000518,"(1R,4S,5R,8S,9R,10S,12R,13R)-1,5,9-trimethyl-11,14,15,16-tetraoxatetracyclo[10.3.1.04,13.08,13]hexadecan-10-ol",Alaxin,C15H24O5,284.35,CC1CCC2C(C(OC3C24C1CCC(O3)(OO4)C)O)C,"['Dihydroartemisinin', 'Artenimol', 'Alaxin', 'Dihydroartemisinine', 'DHQHS 2', 'Di-hydroqinghaosu', 'Artenimol [INN]', 'GNF-PF-5634', 'ARTENIMOL [MART.]', 'ARTENIMOL [WHO-DD]']"
6917864,"4-oxo-4-[[(1R,4S,5R,8S,9R,10S,12R,13R)-1,5,9-trimethyl-11,14,15,16-tetraoxatetracyclo[10.3.1.04,13.08,13]hexadecan-10-yl]oxy]butanoic acid",Asumax,C19H28O8,384.4,CC1CCC2C(C(OC3C24C1CCC(O3)(OO4)C)OC(=O)CCC(=O)O)C,"['Artesunate', 'Arsumax', 'Plasmotrin', 'Qinghaozhi', 'Saphnate', '88495-63-0', 'Artesunato', 'Artesunatum', 'Arinate', 'Dihydroqinghasu hemsuccinate']"
68911,"(1R,4S,5R,8S,9R,10S,12R,13R)-10-methoxy-1,5,9-trimethyl-11,14,15,16-tetraoxatetracyclo[10.3.1.04,13.08,13]hexadecane",Gvither,C16H26O5,298.37,CC1CCC2C(C(OC3C24C1CCC(O3)(OO4)C)OC)C,"['Artemether', '71963-77-4', 'beta-Artemether', 'Dihydroartemisinin methyl ether', 'Artemetero', 'Artemetherum', 'Artesaph', 'Falcidol', 'Malartem', 'Paluther']"
5284616,"(1R,9S,12S,15R,16E,18R,19R,21R,23S,24E,26E,28E,30S,32S,35R)-1,18-dihydroxy-12-[(2R)-1-[(1S,3R,4R)-4-hydroxy-3-methoxycyclohexyl]propan-2-yl]-19,30-dimethoxy-15,17,21,23,29,35-hexamethyl-11,36-dioxa-4-azatricyclo[30.3.1.04,9]hexatriaconta-16,24,26,28-tetraene-2,3,10,14,20-pentone",RPM,C51H79NO13,914.2,CC1CCC2CC(C(=CC=CC=CC(CC(C(=O)C(C(C(=CC(C(=O)CC(OC(=O)C3CCCCN3C(=O)C(=O)C1(O2)O)C(C)CC4CCC(C(C4)OC)O)C)C)O)OC)C)C)C)OC,"['rapamycin', 'Sirolimus', '53123-88-9', '(-)-Rapamycin', 'Rapamune', 'rapalimus', 'AY-22989', 'Supralimus', 'WY-090217', 'HYFTOR']"
6918289,"[(1R,2R,4S)-4-[(2R)-2-[(1R,9S,12S,15R,16E,18R,19R,21R,23S,24E,26E,28E,30S,32S,35R)-1,18-dihydroxy-19,30-dimethoxy-15,17,21,23,29,35-hexamethyl-2,3,10,14,20-pentaoxo-11,36-dioxa-4-azatricyclo[30.3.1.04,9]hexatriaconta-16,24,26,28-tetraen-12-yl]propyl]-2-methoxycyclohexyl] 3-hydroxy-2-(hydroxymethyl)-2-methylpropanoate",Torisel,C56H87NO16,1030.3,CC1CCC2CC(C(=CC=CC=CC(CC(C(=O)C(C(C(=CC(C(=O)CC(OC(=O)C3CCCCN3C(=O)C(=O)C1(O2)O)C(C)CC4CCC(C(C4)OC)OC(=O)C(C)(CO)CO)C)C)O)OC)C)C)C)OC,"['Temsirolimus', '162635-04-3', '624KN6GM2T', 'DTXSID2040945', 'UNII-624KN6GM2T', 'WAY-CCI 779', 'DTXCID0020945', 'HSDB 7931', 'Rapamycin 42-(2,2-bis(hydroxymethyl)propionate)', 'Rapamycin, 42-(3-hydroxy-2-(hydroxymethyl)-2-methylpropanoate)']"
6442177,"(1R,9S,12S,15R,16E,18R,19R,21R,23S,24E,26E,28E,30S,32S,35R)-1,18-dihydroxy-12-[(2R)-1-[(1S,3R,4R)-4-(2-hydroxyethoxy)-3-methoxycyclohexyl]propan-2-yl]-19,30-dimethoxy-15,17,21,23,29,35-hexamethyl-11,36-dioxa-4-azatricyclo[30.3.1.04,9]hexatriaconta-16,24,26,28-tetraene-2,3,10,14,20-pentone",RAD,C53H83NO14,958.2,CC1CCC2CC(C(=CC=CC=CC(CC(C(=O)C(C(C(=CC(C(=O)CC(OC(=O)C3CCCCN3C(=O)C(=O)C1(O2)O)C(C)CC4CCC(C(C4)OC)OCCO)C)C)O)OC)C)C)C)OC,"['Everolimus', 'Afinitor', 'Certican', 'SDZ-RAD', '159351-69-6', '42-O-(2-Hydroxyethyl)rapamycin', 'Zortress', 'Votubia', 'RAD001', '40-O-(2-hydroxyethyl)-rapamycin']"
9926791,"3-[(3R,4R)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile",Tofacitinib,C16H20N6O,312.37,CC1CCN(CC1N(C)C2=NC=NC3=C2C=CN3)C(=O)CC#N,"['Tofacitinib', '477600-75-2', '3-((3R,4R)-4-methyl-3-(methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)piperidin-1-yl)-3-oxopropanenitrile', 'Cp-690 free base', 'tofacitinibum', 'UNII-87LA6FU830', 'CHEBI:71200', '87LA6FU830', 'CP-690550 FREE BASE', 'CP-690,550 FREE BASE']"
10174505,"2-hydroxypropane-1,2,3-tricarboxylic acid;3-[(3R,4R)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile",Xeljanz,C22H28N6O8,504.5,CC1CCN(CC1N(C)C2=NC=NC3=C2C=CN3)C(=O)CC#N.C(C(=O)O)C(CC(=O)O)(C(=O)O)O,"['Tofacitinib citrate', '540737-29-9', 'Xeljanz', 'CP-690550 citrate', 'Xeljanz Xr', 'Tasocitinib monocitrate', 'UNII-O1FF4DIV0D', 'O1FF4DIV0D', 'CP-690550-10', 'CHEBI:71197']"
24775005,"N-[6-[(2S,6R)-2,6-dimethylmorpholin-4-yl]pyridin-3-yl]-2-methyl-3-[4-(trifluoromethoxy)phenyl]benzamide",Odomzo,C26H26F3N3O3,485.5,CC1CN(CC(O1)C)C2=NC=C(C=C2)NC(=O)C3=CC=CC(=C3C)C4=CC=C(C=C4)OC(F)(F)F,"['Erismodegib', 'Sonidegib', '956697-53-3', 'NVP-LDE225', 'LDE-225', 'NVP-LDE 225', 'LDE 225', 'Odomozo', 'UNII-0RLU3VTK5M', '0RLU3VTK5M']"
25262965,"[5-[2,4-bis[(3S)-3-methylmorpholin-4-yl]pyrido[2,3-d]pyrimidin-7-yl]-2-methoxyphenyl]methanol",s1555,C25H31N5O4,465.5,CC1COCCN1C2=NC(=NC3=C2C=CC(=N3)C4=CC(=C(C=C4)OC)CO)N5CCOCC5C,"['AZD8055', '1009298-09-2', 'AZD-8055', 'AZD 8055', '970JJ37FPW', '[5-[2,4-Bis((3S)-3-methylmorpholin-4-yl)pyrido[2,3-d]pyrimidin-7-yl]-2-methoxyphenyl]methanol', '(5-(2,4-bis((3S)-3-methylmorpholin-4-yl)pyrido(2,3-d)pyrimidin-7-yl)-2-methoxyphenyl)methanol', 'AZ-12600000', 'CHEBI:91329', 'AZD 8055 [WHO-DD]']"
118869362,"(3R)-3-methyl-4-[4-(2-methylpyrazol-3-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine",s9864,C20H21N7O,375.4,CC1COCCN1C2=NC3=C(C=CN=C3C4=CC=NN4)C(=C2)C5=CC=NN5C,"['elimusertib', 'BAY-1895344', 'BAY 1895344', '7N13IK9LNH', 'BAY1895344', 'UNII-7N13IK9LNH', '(R)-3-methyl-4-(4-(1-methyl-1H-pyrazol-5-yl)-8-(1H-pyrazol-3-yl)-1,7-naphthyridin-2-yl)morpholine', '(3R)-3-methyl-4-[4-(2-methylpyrazol-3-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine', 'ELIMUSERTIB [INN]', 'ELIMUSERTIB [WHO-DD]']"
32798,"[(8S,9R,10S,11S,13S,14S,16S,17R)-17-(2-chloroacetyl)-9-fluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] propanoate",XRD,C25H32ClFO5,467.0,CCC(=O)OC1(C(CC2C1(CC(C3(C2CCC4=CC(=O)C=CC43C)F)O)C)C)C(=O)CCl,"['CLOBETASOL PROPIONATE', '25122-46-7', 'Clobetasol 17-propionate', 'Clobesol', 'Temovate E', 'Olux-E', 'Dermoxinale', 'Butavate', 'Dermoval', 'Yugofin']"
21800,"[2-[(8S,9R,10S,11S,13S,14S,16S,17R)-9-fluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-17-propanoyloxy-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] propanoate",Psorion,C28H37FO7,504.6,CCC(=O)OCC(=O)C1(C(CC2C1(CC(C3(C2CCC4=CC(=O)C=CC43C)F)O)C)C)OC(=O)CC,"['BETAMETHASONE DIPROPIONATE', 'Diprolene', 'Diprosone', 'Alphatrex', 'Maxivate', 'Diprolene AF', 'Diproderm', 'Psorion', 'Rinderon DP', 'Diprosis']"
468595,"4-[4-[4-[4-[[(3R,5R)-5-(2,4-difluorophenyl)-5-(1,2,4-triazol-1-ylmethyl)oxolan-3-yl]methoxy]phenyl]piperazin-1-yl]phenyl]-2-[(2S,3S)-2-hydroxypentan-3-yl]-1,2,4-triazol-3-one",POS,C37H42F2N8O4,700.8,CCC(C(C)O)N1C(=O)N(C=N1)C2=CC=C(C=C2)N3CCN(CC3)C4=CC=C(C=C4)OCC5CC(OC5)(CN6C=NC=N6)C7=C(C=C(C=C7)F)F,"['Posaconazole', '171228-49-2', 'Noxafil', 'Sch 56592', 'SCH-56592', 'Posaconazole SP', 'SCH56592', 'posaconazol', 'Schering 56592', '(-)-POSACONAZOLE']"
16759173,"sodium;(3R,5R)-7-[(1S,2S,6S,8S,8aR)-6-hydroxy-2-methyl-8-[(2S)-2-methylbutanoyl]oxy-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]-3,5-dihydroxyheptanoate",Vasen,C23H35NaO7,446.5,CCC(C)C(=O)OC1CC(C=C2C1C(C(C=C2)C)CCC(CC(CC(=O)[O-])O)O)O.[Na+],"['PRAVASTATIN SODIUM', '81131-70-6', 'Pravastatin Sodium Salt', 'Dehypotin protect', 'CHEBI:8361', 'DTXSID6047525', '3M8608UQ61', 'NSC-759253', 'DTXCID4027525', 'PRAVIGARD PAC COMPONENT PRAVASTATIN SODIUM']"
6321424,"(1R,4S,5'S,6R,6'R,8R,10E,12S,13S,14E,16E,20R,21R,24S)-6'-[(2S)-butan-2-yl]-21,24-dihydroxy-12-[(2R,4S,5S,6S)-5-[(2S,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methoxy-6-methyloxan-2-yl]oxy-5',11,13,22-tetramethylspiro[3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene-6,2'-oxane]-2-one",IVM,C48H74O14,875.1,CCC(C)C1C(CCC2(O1)CC3CC(O2)CC=C(C(C(C=CC=C4COC5C4(C(C=C(C5O)C)C(=O)O3)O)C)OC6CC(C(C(O6)C)OC7CC(C(C(O7)C)O)OC)OC)C)C,"['Ivermectin B1a', 'IVERMECTIN', 'Dihydroavermectin B1a', '70288-86-7', '71827-03-7', '22,23-Dihydroavermectin B1a', '70161-11-4', 'Stromectol', 'Ivermectin Component B1a', 'avermectin H2B1a']"
60699,"(19S)-8-[(dimethylamino)methyl]-19-ethyl-7,19-dihydroxy-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaene-14,18-dione;hydrochloride",Evotopin,C23H24ClN3O5,457.9,CCC1(C2=C(COC1=O)C(=O)N3CC4=CC5=C(C=CC(=C5CN(C)C)O)N=C4C3=C2)O.Cl,"['TOPOTECAN HYDROCHLORIDE', '119413-54-6', 'Topotecan Hcl', 'Topotecan monohydrochloride', 'Evotopin', 'Topotecan teva', 'Topotecan Hospira', 'SK&F S-104864-A', 'Hycamptamine hydrochloride', 'potactasol']"
5388983,"methyl (1R,9R,10S,11R,12R,19R)-11-acetyloxy-12-ethyl-4-[(13S,15R,17S)-17-ethyl-17-hydroxy-13-methoxycarbonyl-1,11-diazatetracyclo[13.3.1.04,12.05,10]nonadeca-4(12),5,7,9-tetraen-13-yl]-10-hydroxy-5-methoxy-8-methyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6,13-tetraene-10-carboxylate;sulfuric acid",EXAL,C46H60N4O13S,909.1,CCC1(CC2CC(C3=C(CCN(C2)C1)C4=CC=CC=C4N3)(C5=C(C=C6C(=C5)C78CCN9C7C(C=CC9)(C(C(C8N6C)(C(=O)OC)O)OC(=O)C)CC)OC)C(=O)OC)O.OS(=O)(=O)O,"['Vinblastine sulfate', '143-67-9', 'Velsar', 'Velbe', 'EXAL', 'Alkaban-aq', 'VLB monosulfate', 'NSC-49842', 'N00W22YO2B', '29060LE']"
249332,"methyl (1R,9R,10S,11R,12R,19R)-11-acetyloxy-12-ethyl-4-[(13S,15S,17S)-17-ethyl-17-hydroxy-13-methoxycarbonyl-1,11-diazatetracyclo[13.3.1.04,12.05,10]nonadeca-4(12),5,7,9-tetraen-13-yl]-8-formyl-10-hydroxy-5-methoxy-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2,4,6,13-tetraene-10-carboxylate;sulfuric acid",Vincrex,C46H58N4O14S,923.0,CCC1(CC2CC(C3=C(CCN(C2)C1)C4=CC=CC=C4N3)(C5=C(C=C6C(=C5)C78CCN9C7C(C=CC9)(C(C(C8N6C=O)(C(=O)OC)O)OC(=O)C)CC)OC)C(=O)OC)O.OS(=O)(=O)O,"['Vincristine sulfate', '2068-78-2', 'Kyocristine', 'Novopharm', 'Leurocristine sulfate', 'NSC 67574', 'Vincrex', 'Vincristine, sulfate', '22-oxovincaleukoblastine sulfate', 'Leurocristine, sulfate']"
9827599,"(Z)-but-2-enedioic acid;5-[(1R)-2-[(5,6-diethyl-2,3-dihydro-1H-inden-2-yl)amino]-1-hydroxyethyl]-8-hydroxy-1H-quinolin-2-one",I0927,C28H32N2O7,508.6,CCC1=C(C=C2CC(CC2=C1)NCC(C3=C4C=CC(=O)NC4=C(C=C3)O)O)CC.C(=CC(=O)O)C(=O)O,"['Indacaterol maleate', '753498-25-8', 'Indacterol maleate', 'QAB149-AFA', 'QAB-149-AFA', 'Indacaterol (as maleate)', 'UNII-2JEC1ITX7R', '2JEC1ITX7R', 'QAB 149AFA', 'CHEBI:68573']"
67501411,"3-ethyl-4-[4-[4-(1-methylpyrazol-4-yl)imidazol-1-yl]-3-propan-2-ylpyrazolo[3,4-b]pyridin-1-yl]benzamide",Jeselhy,C25H26N8O,454.5,CCC1=C(C=CC(=C1)C(=O)N)N2C3=NC=CC(=C3C(=N2)C(C)C)N4C=C(N=C4)C5=CN(N=C5)C,"['TAS-116', 'Pimitespib', 'Jeselhy', '3-ethyl-4-[4-[4-(1-methylpyrazol-4-yl)imidazol-1-yl]-3-propan-2-ylpyrazolo[3,4-b]pyridin-1-yl]benzamide', 'TAS116', 'PIMITESPIB [INN]', 'PIMITESPIB [JAN]', 'UNII-PLO044MUDZ', 'Tas 116', 'PIMITESPIB [WHO-DD]']"
60838,"[(19S)-10,19-diethyl-19-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] 4-piperidin-1-ylpiperidine-1-carboxylate",Biotecan,C33H38N4O6,586.7,CCC1=C2CN3C(=CC4=C(C3=O)COC(=O)C4(CC)O)C2=NC5=C1C=C(C=C5)OC(=O)N6CCC(CC6)N7CCCCC7,"['irinotecan', '97682-44-5', '(+)-Irinotecan', 'Irinophore C', 'Irinotecanum', 'Biotecan', 'Irinotecan lactone', 'Irinotecan mylan', 'Irinotecanum [INN-Latin]', 'HSDB 7607']"
74990,"[(19S)-10,19-diethyl-19-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4(9),5,7,10,15(20)-heptaen-7-yl] 4-piperidin-1-ylpiperidine-1-carboxylate;hydrochloride",Campto,C33H39ClN4O6,623.1,CCC1=C2CN3C(=CC4=C(C3=O)COC(=O)C4(CC)O)C2=NC5=C1C=C(C=C5)OC(=O)N6CCC(CC6)N7CCCCC7.Cl,"['Irinotecan hydrochloride', '100286-90-6', 'Irinotecan Hcl', 'Topotecin', 'Campto', 'Camptothecin 11', 'Camptothecin 11 hydrochloride', 'U 101440E', 'UNII-06X131E4OE', 'CHEBI:5971']"
46926350,"2-[(2S)-1-[3-ethyl-7-[(1-oxidopyridin-1-ium-3-yl)methylamino]pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-2-yl]ethanol",Dinaciclib,C21H28N6O2,396.5,CCC1=C2N=C(C=C(N2N=C1)NCC3=C[N+](=CC=C3)[O-])N4CCCCC4CCO,"['Dinaciclib', '779353-01-4', 'SCH727965', 'SCH 727965', 'SCH-727965', 'MK-7965', 'DINACICLIB [INN]', 'DINACICLIB [USAN]', '4V8ECV0NBQ', 'DINACICLIB [WHO-DD]']"
4829,"5-[[4-[2-(5-ethylpyridin-2-yl)ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione",Actos,C19H20N2O3S,356.4,CCC1=CN=C(C=C1)CCOC2=CC=C(C=C2)CC3C(=O)NC(=O)S3,"['Pioglitazone', '111025-46-8', 'Glustin', 'Zactos', 'Pioglitazona', 'Pioglitazonum', 'Pioglitazonum [INN-Latin]', 'Pioglitazona [INN-Spanish]', '5-(4-(2-(5-ethylpyridin-2-yl)ethoxy)benzyl)thiazolidine-2,4-dione', 'Piozone']"
10461508,N-[4-[4-(cyclopropylmethyl)piperazin-1-yl]cyclohexyl]-4-[[(7R)-7-ethyl-5-methyl-6-oxo-8-propan-2-yl-7H-pteridin-2-yl]amino]-3-methoxybenzamide,IBI,C34H50N8O3,618.8,CCC1C(=O)N(C2=CN=C(N=C2N1C(C)C)NC3=C(C=C(C=C3)C(=O)NC4CCC(CC4)N5CCN(CC5)CC6CC6)OC)C,"['Volasertib', '755038-65-4', 'BI 6727', 'BI-6727', 'BI6727', 'Volasertib [USAN]', 'volasertibum', 'Volasertib [USAN:INN]', 'Volasertib (USAN)', '6EM57086EA']"
5284373,"(3S,6S,9S,12R,15S,18S,21S,24S,30S,33S)-30-ethyl-33-[(E,1R,2R)-1-hydroxy-2-methylhex-4-enyl]-1,4,7,10,12,15,19,25,28-nonamethyl-6,9,18,24-tetrakis(2-methylpropyl)-3,21-di(propan-2-yl)-1,4,7,10,13,16,19,22,25,28,31-undecazacyclotritriacontane-2,5,8,11,14,17,20,23,26,29,32-undecone",CSA,C62H111N11O12,1202.6,CCC1C(=O)N(CC(=O)N(C(C(=O)NC(C(=O)N(C(C(=O)NC(C(=O)NC(C(=O)N(C(C(=O)N(C(C(=O)N(C(C(=O)N(C(C(=O)N1)C(C(C)CC=CC)O)C)C(C)C)C)CC(C)C)C)CC(C)C)C)C)C)CC(C)C)C)C(C)C)CC(C)C)C)C,"['cyclosporin A', 'Ciclosporin', 'cyclosporine', 'Cyclosporin', '59865-13-3', 'Sandimmune', 'Neoral', 'Cyclosporine A', 'Sandimmun', 'Ciclosporine']"
12560,"(3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-6-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-14-ethyl-7,12,13-trihydroxy-4-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-3,5,7,9,11,13-hexamethyl-oxacyclotetradecane-2,10-dione",ERY,C37H67NO13,733.9,CCC1C(C(C(C(=O)C(CC(C(C(C(C(C(=O)O1)C)OC2CC(C(C(O2)C)O)(C)OC)C)OC3C(C(CC(O3)C)N(C)C)O)(C)O)C)C)O)(C)O,"['erythromycin', '114-07-8', 'Erythromycin A', 'E-Mycin', 'Abomacetin', 'Erythromycinum', 'Emgel', 'Eritromicina', 'Erythromycine', 'Robimycin']"
3033819,"(2R,3S,4R,5R,8R,10R,11R,12S,13S,14R)-11-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-2-ethyl-3,4,10-trihydroxy-13-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-3,5,6,8,10,12,14-heptamethyl-1-oxa-6-azacyclopentadecan-15-one;dihydrate",Odaz,C38H76N2O14,785.0,CCC1C(C(C(N(CC(CC(C(C(C(C(C(=O)O1)C)OC2CC(C(C(O2)C)O)(C)OC)C)OC3C(C(CC(O3)C)N(C)C)O)(C)O)C)C)C)O)(C)O.O.O,"['AZITHROMYCIN DIHYDRATE', 'Azitro', 'Ribotrex', 'Zenstavion', 'Azatek', 'Ultreon', 'Azadose', 'Odaz', 'Aciphar', 'Acitrocin']"
441313,"(2S,3aS,7aS)-1-[(2S)-2-[[(2S)-1-ethoxy-1-oxopentan-2-yl]amino]propanoyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylic acid;2-methylpropan-2-amine",ACEON,C23H43N3O5,441.6,CCCC(C(=O)OCC)NC(C)C(=O)N1C2CCCCC2CC1C(=O)O.CC(C)(C)N,"['PERINDOPRIL ERBUMINE', '107133-36-8', 'ACEON', 'McN-A-2833-109', 'Covapril', 'S-9490-3', 'CHEBI:8025', 'NSC-758929', 'DTXSID1044198', 'UNII-1964X464OJ']"
135398744,"5-[2-ethoxy-5-(4-methylpiperazin-1-yl)sulfonylphenyl]-1-methyl-3-propyl-6H-pyrazolo[4,3-d]pyrimidin-7-one",Patrex,C22H30N6O4S,474.6,CCCC1=NN(C2=C1N=C(NC2=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCN(CC4)C)OCC)C,"['sildenafil', '139755-83-2', 'Aphrodil', 'Vizarsin', 'Patrex', 'Sildenafil teva', 'Sildenafil actavis', 'Sildenafil ratiopharm', 'Sildenafilo', 'HSDB 7305']"
5281004,"(1S,2S,4R,8S,9S,11S,12S,13R)-11-hydroxy-8-(2-hydroxyacetyl)-9,13-dimethyl-6-propyl-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-16-one",Noex,C25H34O6,430.5,CCCC1OC2CC3C4CCC5=CC(=O)C=CC5(C4C(CC3(C2(O1)C(=O)CO)C)O)C,"['budesonide', '51333-22-3', 'Entocort', 'Preferid', 'Budeson', 'Rhinocort Aqua', 'Entocort EC', 'Cortivent', 'Micronyl', 'Respules']"
3610,"4-hexylbenzene-1,3-diol",Oxana,C12H18O2,194.27,CCCCCCC1=C(C=C(C=C1)O)O,"['hexylresorcinol', '4-Hexyl-1,3-benzenediol', 'p-Hexylresorcinol', 'Mycoderm', 'EverFresh', 'R9QTB5E82N', 'INS NO.586', 'INS-586', 'NSC1570', ""1-(2',4'-Dihydroxyphenyl)hexane""]"
445639,(Z)-octadec-9-enoic acid,Ole,C18H34O2,282.5,CCCCCCCCC=CCCCCCCCC(=O)O,"['oleic acid', '112-80-1', 'cis-9-Octadecenoic acid', 'cis-Oleic acid', 'Wecoline OO', 'Elaidoic acid', 'Vopcolene 27', 'Glycon wo', 'Glycon RO', 'Oelsauere']"
107969,"2-amino-2-[2-(4-octylphenyl)ethyl]propane-1,3-diol;hydrochloride",Gilenia,C19H34ClNO2,343.9,CCCCCCCCC1=CC=C(C=C1)CCC(CO)(CO)N.Cl,"['Fingolimod hydrochloride', '162359-56-0', 'Fingolimod HCl', 'Gilenia', 'Fingolimod hydrochlorid', 'FTY720 hydrochloride', '2-Amino-2-(2-(4-octylphenyl)ethyl)-1,3-propanediol hydrochloride', 'CHEBI:63112', 'Fingolimod (as hydrochloride)', 'UNII-G926EC510T']"
21585658,"(3S)-3-[[(2R)-4-amino-2-[[(2S)-2-(decanoylamino)-3-(1H-indol-3-yl)propanoyl]amino]-4-oxobutanoyl]amino]-4-[[(3S,6S,9R,15S,18R,21S,24S,30S,31R)-3-[2-(2-aminophenyl)-2-oxoethyl]-24-(3-aminopropyl)-15,21-bis(carboxymethyl)-6-[(2R)-1-carboxypropan-2-yl]-9-(hydroxymethyl)-18,31-dimethyl-2,5,8,11,14,17,20,23,26,29-decaoxo-1-oxa-4,7,10,13,16,19,22,25,28-nonazacyclohentriacont-30-yl]amino]-4-oxobutanoic acid",Dapcin,C72H101N17O26,1620.7,CCCCCCCCCC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)NC(CC(=O)N)C(=O)NC(CC(=O)O)C(=O)NC3C(OC(=O)C(NC(=O)C(NC(=O)C(NC(=O)CNC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)CNC3=O)CCCN)CC(=O)O)C)CC(=O)O)CO)C(C)CC(=O)O)CC(=O)C4=CC=CC=C4N)C,"['DAPTOMYCIN', 'Cidecin', 'Daptomycinum', 'Dapcin', 'Deptomycin', 'Daptomicina', 'Daptomycine', '103060-53-3', 'Daptomycin for injection', 'UNII-NWQ5N31VKK']"
3034010,"[(2S)-1-[(2S,3S)-3-hexyl-4-oxooxetan-2-yl]tridecan-2-yl] (2S)-2-formamido-4-methylpentanoate",THL,C29H53NO5,495.7,CCCCCCCCCCCC(CC1C(C(=O)O1)CCCCCC)OC(=O)C(CC(C)C)NC=O,"['orlistat', '96829-58-2', 'Tetrahydrolipstatin', 'Xenical', 'Orlipastat', '(-)-Tetrahydrolipstatin', 'Orlipastatum [INN-Latin]', 'Orlipastatum', 'Ro-18-0647', 'Ro 18-0647/002']"
117965,"(2S)-1-butyl-N-(2,6-dimethylphenyl)piperidine-2-carboxamide;hydrochloride",Popscaine,C18H29ClN2O,324.9,CCCCN1CCCCC1C(=O)NC2=C(C=CC=C2C)C.Cl,"['Levobupivacaine hydrochloride', 'Levobupivacaine HCl', 'Bupicaine hydrochloride (-)', ""(S)-1-Butyl-2',6'-pipecoloxylidide monohydrochloride"", 'UNII-J998RDZ51I', 'J998RDZ51I', 'DTXSID9046071', 'CHEBI:31772', '(2S)-1-butyl-N-(2,6-dimethylphenyl)piperidine-2-carboxamide hydrochloride', 'Bupivacaine (-)-form hydrochloride']"
4922,4-benzamido-5-(dipropylamino)-5-oxopentanoic acid,Xyde,C18H26N2O4,334.4,CCCN(CCC)C(=O)C(CCC(=O)O)NC(=O)C1=CC=CC=C1,"['proglumide', '6620-60-6', '4-benzamido-5-(dipropylamino)-5-oxopentanoic acid', 'Binoside', 'Xylamide', 'Milid', 'Nulsa', 'Gastrotopic', 'Midelid', 'Ulcutin']"
6918111,"(2S)-N-(2,6-dimethylphenyl)-1-propylpiperidine-2-carboxamide;hydrate;hydrochloride",Naropin,C17H29ClN2O2,328.9,CCCN1CCCCC1C(=O)NC2=C(C=CC=C2C)C.O.Cl,"['(2S)-N-(2,6-dimethylphenyl)-1-propyl-2-piperidinecarboxamide hydrochloride monohydrate', '2-Piperidinecarboxamide, N-(2,6-dimethylphenyl)-1-propyl-, hydrochloride, hydrate (1:1:1), (2S)-', '663-286-1', '132112-35-7', 'ROPIVACAINE HYDROCHLORIDE MONOHYDRATE', 'Naropin', 'Ropivacaine hydrochloride hydrate', 'Ropivacaine (hydrochloride monohydrate)', 'MFCD00946578', '(2S)-N-(2,6-dimethylphenyl)-1-propylpiperidine-2-carboxamide;hydrate;hydrochloride']"
16004692,5-(4-bromophenyl)-6-[2-(5-bromopyrimidin-2-yl)oxyethoxy]-N-(propylsulfamoyl)pyrimidin-4-amine,Opsumit,C19H20Br2N6O4S,588.3,CCCNS(=O)(=O)NC1=C(C(=NC=N1)OCCOC2=NC=C(C=N2)Br)C3=CC=C(C=C3)Br,"['Macitentan', '441798-33-0', 'Opsumit', 'ACT-064992', 'Actelion-1', 'ACT 064992', 'ACT064992', 'macitentanum', 'UNII-Z9K9Y9WMVL', 'Z9K9Y9WMVL']"
42611257,"N-[3-[5-(4-chlorophenyl)-1H-pyrrolo[2,3-b]pyridine-3-carbonyl]-2,4-difluorophenyl]propane-1-sulfonamide",Zelboraf,C23H18ClF2N3O3S,489.9,CCCS(=O)(=O)NC1=C(C(=C(C=C1)F)C(=O)C2=CNC3=C2C=C(C=N3)C4=CC=C(C=C4)Cl)F,"['Vemurafenib', '918504-65-1', 'PLX-4032', 'N-(3-(5-(4-Chlorophenyl)-1H-pyrrolo[2,3-b]pyridine-3-carbonyl)-2,4-difluorophenyl)propane-1-sulfonamide', 'RO 5185426', 'vemurafenibum', 'N-(3-{[5-(4-chlorophenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]carbonyl}-2,4-difluorophenyl)propane-1-sulfonamide', 'UNII-207SMY3FQT', '207SMY3FQT', 'N-[3-[5-(4-chlorophenyl)-1H-pyrrolo[2,3-b]pyridine-3-carbonyl]-2,4-difluorophenyl]propane-1-sulfonamide']"
6314,"2-(diethylamino)-N-(2,6-dimethylphenyl)acetamide;hydrochloride",Glydo,C14H23ClN2O,270.80,CCN(CC)CC(=O)NC1=C(C=CC=C1C)C.Cl,"['Lidocaine hydrochloride', '73-78-9', 'LIDOCAINE HCL', 'Xyloneural', 'Lignocaine hydrochloride', 'Xylocaine Viscous', 'Laryng-O-jet', 'Xilina hydrochloride', 'Anestacon', 'Rucaina hydrochloride']"
5329102,"N-[2-(diethylamino)ethyl]-5-[(Z)-(5-fluoro-2-oxo-1H-indol-3-ylidene)methyl]-2,4-dimethyl-1H-pyrrole-3-carboxamide",Sutent,C22H27FN4O2,398.5,CCN(CC)CCNC(=O)C1=C(NC(=C1C)C=C2C3=C(C=CC(=C3)F)NC2=O)C,"['Sunitinib', '557795-19-4', 'sunitinibum', 'Su-011248', 'NSC-750690', 'UNII-V99T50803M', 'CHEBI:38940', 'HSDB 7932', 'NSC-736511', 'V99T50803M']"
66068,4-amino-N-[2-(diethylamino)ethyl]benzamide;hydrochloride,Procan,C13H22ClN3O,271.78,CCN(CC)CCNC(=O)C1=CC=C(C=C1)N.Cl,"['procainamide hydrochloride', '614-39-1', 'Procainamide Hcl', 'Procapan', 'Procan SR', '4-amino-N-[2-(diethylamino)ethyl]benzamide hydrochloride', 'Pronestyl-Sr', 'Procainhydrochlorid', 'Procainii chloridum', 'Promide hydrochloride']"
10180,1-[2-(diethylamino)ethylamino]-4-methylthioxanthen-9-one,Lucanthon,C20H24N2OS,340.5,CCN(CC)CCNC1=C2C(=C(C=C1)C)SC3=CC=CC=C3C2=O,"['LUCANTHONE', '479-50-5', 'Lucanthon', 'Lucanthonum', 'Lucantona', 'Lucanthonum [INN-Latin]', 'Lucantona [INN-Spanish]', 'Lucanthone [INN:BAN]', '1-((2-(Diethylamino)ethyl)amino)-4-methylthioxanthen-9-one', '1-((2-(diethylamino)ethyl)amino)-4-methyl-9H-thioxanthen-9-one']"
164726578,"(1S,2S)-N-[(7S,13S)-21-ethyl-20-[2-[(1S)-1-methoxyethyl]-5-(4-methylpiperazin-1-yl)pyridin-3-yl]-17,17-dimethyl-8,14-dioxo-15-oxa-4-thia-9,21,27,28-tetrazapentacyclo[17.5.2.12,5.19,13.022,26]octacosa-1(25),2,5(28),19,22(26),23-hexaen-7-yl]-2-methylcyclopropane-1-carboxamide",Daraxonrasib,C44H58N8O5S,811.0,CCN1C2=C3C=C(C=C2)C4=CSC(=N4)CC(C(=O)N5CCCC(N5)C(=O)OCC(CC3=C1C6=C(N=CC(=C6)N7CCN(CC7)C)C(C)OC)(C)C)NC(=O)C8CC8C,"['RAS-IN-2', 'RMC-6236', 'Daraxonrasib', '2765081-21-6', 'RMC6236', 'RAS Inhibitor A122', 'A1AHB', 'daraxonrasib [INN]', 'B6T47Y2UAP', 'SCHEMBL25774297']"
86705695,"11-(2,6-difluoro-3,5-dimethoxyphenyl)-13-ethyl-4-(morpholin-4-ylmethyl)-5,7,11,13-tetrazatricyclo[7.4.0.02,6]trideca-1,3,6,8-tetraen-12-one",Pemazyre,C24H27F2N5O4,487.5,CCN1C2=C3C=C(NC3=NC=C2CN(C1=O)C4=C(C(=CC(=C4F)OC)OC)F)CN5CCOCC5,"['Pemigatinib', '1513857-77-6', 'Fgfr inhibitor INCB054828', 'INCB54828', 'Y6BX7BL23K', 'INCB-54828', 'UNII-Y6BX7BL23K', 'INCB 54828', ""2H-Pyrrolo(3',2':5,6)pyrido(4,3-d)pyrimidin-2-one, 3-(2,6-difluoro-3,5-dimethoxyphenyl)-1-ethyl-1,3,4,7-tetrahydro-8-(4-morpholinylmethyl)-"", ""3-(2,6-DIFLUORO-3,5-DIMETHOXYPHENYL)-1-ETHYL-8-(MORPHOLIN-4-YLMETHYL)-1,3,4,7-TETRAHYDRO-2H-PYRROLO(3',2':5,6)PYRIDO(4,3-D)PYRIMIDIN-2-ONE""]"
53235510,"3-(2,6-dichloro-3,5-dimethoxyphenyl)-1-[6-[4-(4-ethylpiperazin-1-yl)anilino]pyrimidin-4-yl]-1-methylurea",Infigratinib,C26H31Cl2N7O3,560.5,CCN1CCN(CC1)C2=CC=C(C=C2)NC3=CC(=NC=N3)N(C)C(=O)NC4=C(C(=CC(=C4Cl)OC)OC)Cl,"['Infigratinib', '872511-34-7', 'NVP-BGJ398', 'BGJ398', 'BGJ-398', 'BGJ 398', '3-(2,6-dichloro-3,5-dimethoxyphenyl)-1-(6-((4-(4-ethylpiperazin-1-yl)phenyl)amino)pyrimidin-4-yl)-1-methylurea', 'UNII-A4055ME1VK', 'A4055ME1VK', 'CHEBI:63451']"
53340664,"N-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]-4-methyl-3-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)benzamide",NG2,C29H30F3N5O2,537.6,CCN1CCN(CC1)CC2=C(C=C(C=C2)NC(=O)C3=CC(=C(C=C3)C)OC4=C5C=CNC5=NC=C4)C(F)(F)F,"['1315355-93-1', 'NG-25', 'N-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]-4-methyl-3-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)benzamide', 'N-(4-((4-ethylpiperazin-1-yl)methyl)-3-(trifluoromethyl)phenyl)-4-methyl-3-(1H-pyrrolo(2,3-b)pyridin-4-yloxy)benzamide', 'N-{4-[(4-Ethylpiperazin-1-Yl)methyl]-3-(Trifluoromethyl)phenyl}-4-Methyl-3-(1h-Pyrrolo[2,3-B]pyridin-4-Yloxy)benzamide', 'N-{4-[(4-ETHYLPIPERAZIN-1-YL)METHYL]-3-(TRIFLUOROMETHYL)PHENYL}-4-METHYL-3-{1H-PYRROLO[2,3-B]PYRIDIN-4-YLOXY}BENZAMIDE', 'NG25', 'Benzamide, N-[4-[(4-ethyl-1-piperazinyl)methyl]-3-(trifluoromethyl)phenyl]-4-methyl-3-(1H-pyrrolo[2,3-b]pyridin-4-yloxy)-', '3-((1H-Pyrrolo[2,3-b]pyridin-4-yl)oxy)-N-(4-((4-ethylpiperazin-1-yl)methyl)-3-(trifluoromethyl)phenyl)-4-methylbenzamide', 'CHEMBL4125960']"
46220502,N-[5-[(4-ethylpiperazin-1-yl)methyl]pyridin-2-yl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine,Verzenio,C27H32F2N8,506.6,CCN1CCN(CC1)CC2=CN=C(C=C2)NC3=NC=C(C(=N3)C4=CC5=C(C(=C4)F)N=C(N5C(C)C)C)F,"['Abemaciclib', '1231929-97-7', 'Verzenio', 'UNII-60UAB198HK', 'Verzenios', '60UAB198HK', 'LY 2835219', 'HY-16297A', 'CS-1230', 'LY 2835210']"
5311027,"(Z)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(E,3S)-3-hydroxy-5-phenylpent-1-enyl]cyclopentyl]-N-ethylhept-5-enamide",DURYSTA,C25H37NO4,415.6,CCNC(=O)CCCC=CCC1C(CC(C1C=CC(CCC2=CC=CC=C2)O)O)O,"['Bimatoprost', '155206-00-1', 'Prostamide', 'bimatoprostum', 'AGN-192024', 'UNII-QXS94885MZ', 'DURYSTA', 'QXS94885MZ', 'CHEBI:51230', 'LS-181817']"
6918132,"(4S,6S)-4-(ethylamino)-6-methyl-7,7-dioxo-5,6-dihydro-4H-thieno[2,3-b]thiopyran-2-sulfonamide;hydrochloride",Cosopt,C10H17ClN2O4S3,360.9,CCNC1CC(S(=O)(=O)C2=C1C=C(S2)S(=O)(=O)N)C.Cl,"['DORZOLAMIDE HYDROCHLORIDE', '130693-82-2', 'Dorzolamide HCl', '(4S,6S)-4-(ethylamino)-6-methyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran-2-sulfonamide 7,7-dioxide hydrochloride', 'UNII-QZO5366EW7', 'Dorzolamide (as hydrochloride)', 'QZO5366EW7', 'DTXSID1045530', 'MK 0507', 'MK-0507']"
5381,"ethyl 6-[2-(4,4-dimethyl-2,3-dihydrothiochromen-6-yl)ethynyl]pyridine-3-carboxylate",Zora,C21H21NO2S,351.5,CCOC(=O)C1=CN=C(C=C1)C#CC2=CC3=C(C=C2)SCCC3(C)C,"['tazarotene', '118292-40-3', 'Tazorac', 'Ethyl 6-((4,4-dimethylthiochroman-6-yl)ethynyl)nicotinate', 'Zorac', 'Avage', 'AGN-190168', 'Fabior', 'tazaroteno', 'tazarotenum']"
9915743,(E)-N-[4-[3-chloro-4-(pyridin-2-ylmethoxy)anilino]-3-cyano-7-ethoxyquinolin-6-yl]-4-(dimethylamino)but-2-enamide,Neratinib,C30H29ClN6O3,557.0,CCOC1=C(C=C2C(=C1)N=CC(=C2NC3=CC(=C(C=C3)OCC4=CC=CC=N4)Cl)C#N)NC(=O)C=CCN(C)C,"['Neratinib', '698387-09-6', 'UNII-JJH94R3PWB', 'JJH94R3PWB', '(2E)-N-[4-[[3-chloro-4-[(pyridin-2-yl)methoxy]phenyl]amino]-3-cyano-7-ethoxyquinolin-6-yl]-4-(dimethylamino)but-2-enamide', 'PB-272', 'CDP-820', 'PB 272', 'CHEBI:61397', 'DTXSID70220132']"
67307512,(Z)-but-2-enedioic acid;(E)-N-[4-[3-chloro-4-(pyridin-2-ylmethoxy)anilino]-3-cyano-7-ethoxyquinolin-6-yl]-4-(dimethylamino)but-2-enamide,Nerlynx,C34H33ClN6O7,673.1,CCOC1=C(C=C2C(=C1)N=CC(=C2NC3=CC(=C(C=C3)OCC4=CC=CC=N4)Cl)C#N)NC(=O)C=CCN(C)C.C(=CC(=O)O)C(=O)O,"['Neratinib maleate', '915942-22-2', 'hki-272 maleate', 'Nerlynx', 'UNII-9RM7XY23ZS', '9RM7XY23ZS', 'NERATINIB MALEATE ANHYDROUS', '2-Butenamide, N-(4-((3-chloro-4-(2-pyridinylmethoxy)phenyl)amino)-3-cyano-7-ethoxy-6-quinolinyl)-4-(dimethylamino)-, (2E)-, (2Z)-2-butenedioate (1:1)', 'Neratinib maleate [MI]', 'Neratinib (maleate)']"
9887712,"(2S,3R,4R,5S,6R)-2-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-6-(hydroxymethyl)oxane-3,4,5-triol",Forxiga,C21H25ClO6,408.9,CCOC1=CC=C(C=C1)CC2=C(C=CC(=C2)C3C(C(C(C(O3)CO)O)O)O)Cl,"['Dapagliflozin', '461432-26-8', '(2S,3R,4R,5S,6R)-2-(4-chloro-3-(4-ethoxybenzyl)phenyl)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol', 'dapagliflozine', 'Dapagliflozina', 'UNII-1ULL0QJ8UC', '1ULL0QJ8UC', 'CHEBI:85078', 'LYN-045', 'DTXSID20905104']"
24906252,"(2S,3R,4R,5S,6R)-2-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-6-(hydroxymethyl)oxane-3,4,5-triol;(2S)-propane-1,2-diol;hydrate",s5566,C24H35ClO9,503.0,CCOC1=CC=C(C=C1)CC2=C(C=CC(=C2)C3C(C(C(C(O3)CO)O)O)O)Cl.CC(CO)O.O,"['dapagliflozin propanediol monohydrate', 'Dapagliflozin propanediol', 'Dapagliflozin S-propylene glycol monohydrate', 'Dapagliflozin propylene glycol hydrate', 'UNII-887K2391VH', 'CHEBI:85079', '887K2391VH', 'dapagliflozin (S)-propylene glycol hydrate', 'XIGDUO COMPONENT DAPAGLIFLOZIN PROPANEDIOL', 'DAPAGLIFLOZIN COMPOUND WITH (2S)-1,2-PROPANEDIOL HYDRATE']"
24199313,"gold(1+);3,4,5-triacetyloxy-6-(acetyloxymethyl)oxane-2-thiolate;triethylphosphane",D78135,C20H34AuO9PS,678.5,CCP(CC)CC.CC(=O)OCC1C(C(C(C(O1)[S-])OC(=O)C)OC(=O)C)OC(=O)C.[Au+],"['34031-32-8', '(1-Thio-beta-D-glucopyranosato)(triethylphosphine)gold 2,3,4,6-tetraacetate', 'gold(1+);3,4,5-triacetyloxy-6-(acetyloxymethyl)oxane-2-thiolate;triethylphosphane', 'MFCD00080759', 'MMV688978', 'AUJRCFUBUPVWSZ-UHFFFAOYSA-M', 'BCP08217', 'SKF 39162', 'AKOS026750078', 'MA05382']"
16124208,"5-(3-ethylsulfonylphenyl)-3,8-dimethyl-N-(1-methylpiperidin-4-yl)-9H-pyrido[2,3-b]indole-7-carboxamide",s2718,C28H32N4O3S,504.6,CCS(=O)(=O)C1=CC=CC(=C1)C2=CC(=C(C3=C2C4=C(N3)N=CC(=C4)C)C)C(=O)NC5CCN(CC5)C,"['TAK-901', '934541-31-8', 'TAK 901', 'DM9UIR23R7', '5-[3-(ethanesulfonyl)phenyl]-3,8-dimethyl-N-(1-methylpiperidin-4-yl)-9H-pyrido[2,3-b]indole-7-carboxamide', '9H-PYRIDO(2,3-B)INDOLE-7-CARBOXAMIDE, 5-(3-(ETHYLSULFONYL)PHENYL)-3,8-DIMETHYL-N-(1-METHYL-4-PIPERIDINYL)-', '5-(3-(ethanesulfonyl)phenyl)-3,8-dimethyl-N-(1-methylpiperidin-4-yl)-9H-pyrido(2,3-b)indole-7-carboxamide', 'Aurora B Serine/Threonine Kinase Inhibitor TAK-901', '5-(3-(ethylsulfonyl)phenyl)-3,8-dimethyl-N-(1-methylpiperidin-4-yl)-9H-pyrido[2,3-b]indole-7-carboxamide', '5-[3-(Ethylsulfonyl)phenyl]-3,8-dimethyl-N-(1-methyl-4-piperidinyl)-9H-pyrido[2,3-b]indole-7-carboxamide']"
71420,"4-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-N,N-dimethyl-2,2-diphenylbutanamide;hydrochloride",BLOX,C29H34Cl2N2O2,513.5,CN(C)C(=O)C(CCN1CCC(CC1)(C2=CC=C(C=C2)Cl)O)(C3=CC=CC=C3)C4=CC=CC=C4.Cl,"['Loperamide hydrochloride', '34552-83-5', 'Loperamide HCl', 'Suprasec', 'Dissenten', 'Imosec', 'Lopemid', 'Lopemin', 'Loperyl', 'Tebloc']"
44631912,"7-cyclopentyl-N,N-dimethyl-2-[(5-piperazin-1-ylpyridin-2-yl)amino]pyrrolo[2,3-d]pyrimidine-6-carboxamide",Kisqali,C23H30N8O,434.5,CN(C)C(=O)C1=CC2=CN=C(N=C2N1C3CCCC3)NC4=NC=C(C=C4)N5CCNCC5,"['Ribociclib', '1211441-98-3', 'LEE011', 'LEE-011', 'LEE 011', '7-cyclopentyl-N,N-dimethyl-2-((5-(piperazin-1-yl)pyridin-2-yl)amino)-7H-pyrrolo[2,3-d]pyrimidine-6-carboxamide', 'LEE011A', 'UNII-TK8ERE8P56', 'TK8ERE8P56', '7-cyclopentyl-N,N-dimethyl-2-{[5-(piperazin-1-yl)pyridin-2-yl]amino}-7H-pyrrolo[2,3-d]pyrimidine-6-carboxamide']"
2123,"2-N,2-N,4-N,4-N,6-N,6-N-hexamethyl-1,3,5-triazine-2,4,6-triamine",HMM,C9H18N6,210.28,CN(C)C1=NC(=NC(=N1)N(C)C)N(C)C,"['altretamine', '645-05-6', 'HEXAMETHYLMELAMINE', 'Hexalen', 'Hexastat', 'Hemel', 'Altretamina', 'Altretaminum', 'ENT 50852', '2,4,6-Tris(dimethylamino)-s-triazine']"
54680690,"(4S,4aS,5aS,6S,12aR)-7-chloro-4-(dimethylamino)-1,6,10,11,12a-pentahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide",DMCT,C21H21ClN2O8,464.9,CN(C)C1C2CC3C(C4=C(C=CC(=C4C(=C3C(=O)C2(C(=C(C1=O)C(=O)N)O)O)O)O)Cl)O,"['demeclocycline', '127-33-3', 'DMCT', 'Ledermycin', 'Demethylchlortetracyclin', 'Demeclociclina', '6-Demethyl-7-chlorotetracycline', '7-Chloro-6-demethyltetracycline', 'Demeclocyclinum', 'Demethylchlorotetracycline']"
10184653,(E)-N-[4-(3-chloro-4-fluoroanilino)-7-[(3S)-oxolan-3-yl]oxyquinazolin-6-yl]-4-(dimethylamino)but-2-enamide,Tovok,C24H25ClFN5O3,485.9,CN(C)CC=CC(=O)NC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC(=C(C=C3)F)Cl)OC4CCOC4,"['Afatinib', '850140-72-6', 'Tovok', 'Tomtovok', 'afatinibum', 'NSC-750691', 'UNII-41UD74L59M', 'CHEBI:61390', '41UD74L59M', '(2E)-N-{4-[(3-chloro-4-fluorophenyl)amino]-7-[(3S)-tetrahydrofuran-3-yloxy]quinazolin-6-yl}-4-(dimethylamino)but-2-enamide']"
10348973,"1-[4-[1-[(2,6-difluorophenyl)methyl]-5-[(dimethylamino)methyl]-3-(6-methoxypyridazin-3-yl)-2,4-dioxothieno[2,3-d]pyrimidin-6-yl]phenyl]-3-methoxyurea",Orgovyx,C29H27F2N7O5S,623.6,CN(C)CC1=C(SC2=C1C(=O)N(C(=O)N2CC3=C(C=CC=C3F)F)C4=NN=C(C=C4)OC)C5=CC=C(C=C5)NC(=O)NOC,"['Relugolix', '737789-87-6', 'TAK-385', 'Orgovyx', '1-(4-(1-(2,6-difluorobenzyl)-5-((dimethylamino)methyl)-3-(6-methoxypyridazin-3-yl)-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidin-6-yl)phenyl)-3-methoxyurea', 'UNII-P76B05O5V6', 'P76B05O5V6', 'MYFEMBREE COMPONENT RELUGOLIX', ""N-(4-(1-((2,6-Difluorophenyl)methyl)-5-((dimethylamino)methyl)-1,2,3,4-tetrahydro-3-(6-methoxy-3-pyridazinyl)-2,4-dioxothieno(2,3-d)pyrimidin-6-yl)phenyl)-N'-methoxyurea"", ""Urea, N-(4-(1-((2,6-difluorophenyl)methyl)-5-((dimethylamino)methyl)-1,2,3,4-tetrahydro-3-(6-methoxy-3-pyridazinyl)-2,4-dioxothieno(2,3-d)pyrimidin-6-yl)phenyl)-N'-methoxy-""]"
77995,1-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-3H-2-benzofuran-5-carbonitrile;hydrobromide,Celexa,C20H22BrFN2O,405.3,CN(C)CCCC1(C2=C(CO1)C=C(C=C2)C#N)C3=CC=C(C=C3)F.Br,"['citalopram hydrobromide', '59729-32-7', 'Citalopram HBr', 'Elopram', 'Lu 10-171-B', 'EINECS 261-890-6', 'Citalopram (as hydrobromide)', 'NSC-758684', 'UNII-I1E9D14F36', 'I1E9D14F36']"
137319707,N-[5-[[4-(1-cyclopropylindol-3-yl)pyrimidin-2-yl]amino]-2-[2-(dimethylamino)ethyl-methylamino]-4-methoxyphenyl]prop-2-enamide;hydrochloride,D81089,C30H36ClN7O2,562.1,CN(C)CCN(C)C1=CC(=C(C=C1NC(=O)C=C)NC2=NC=CC(=N2)C3=CN(C4=CC=CC=C43)C5CC5)OC.Cl,"['HS-10296 hydrochloride', '2134096-03-8', 'ALMONERTINIB HYDROCHLORIDE', 'Almonertinib (hydrochloride)', 'N-(5-((4-(1-Cyclopropyl-1H-indol-3-yl)pyrimidin-2-yl)amino)-2-((2-(dimethylamino)ethyl)(methyl)amino)-4-methoxyphenyl)acrylamide hydrochloride', 'N-[5-[[4-(1-cyclopropylindol-3-yl)pyrimidin-2-yl]amino]-2-[2-(dimethylamino)ethyl-methylamino]-4-methoxyphenyl]prop-2-enamide;hydrochloride', 'N-(5-{[4-(1-cyclopropylindol-3-yl)pyrimidin-2-yl]amino}-2-{[2-(dimethylamino)ethyl](methyl)amino}-4-methoxyphenyl)prop-2-enamide hydrochloride', 'MFCD31807629', 'JKD09603', 'AKOS040758785']"
162368359,N-[5-[[4-(1-cyclopropylindol-3-yl)pyrimidin-2-yl]amino]-2-[2-(dimethylamino)ethyl-methylamino]-4-methoxyphenyl]prop-2-enamide;methanesulfonic acid,ameile,C31H39N7O5S,621.8,CN(C)CCN(C)C1=CC(=C(C=C1NC(=O)C=C)NC2=NC=CC(=N2)C3=CN(C4=CC=CC=C43)C5CC5)OC.CS(=O)(=O)O,"['Almonertinib mesylate', '2134096-06-1', 'Aumolertinib mesylate', 'HS-10296 Mesylate', 'RZ6I9WX68U', 'Aumolertinib mesylate [USAN]', 'Aumolertinib mesilate', 'EQ143 MESYLATE', 'HS-10296 Methanesulfonate', 'Aumolertinib mesylate (USAN)']"
3100,"2-benzhydryloxy-N,N-dimethylethanamine",Nausen,C17H21NO,255.35,CN(C)CCOC(C1=CC=CC=C1)C2=CC=CC=C2,"['diphenhydramine', '58-73-1', 'Benzhydramine', 'Alledryl', 'Probedryl', 'Dihidral', 'Antistominum', 'Benzhydraminum', 'Benzhydroamina', 'Diphantine']"
51003603,"(E)-3-(3-chlorophenyl)-N-[2-[(1,1-dioxothian-4-yl)-methylamino]-2-oxoethyl]prop-2-enamide",ML264,C17H21ClN2O4S,384.9,CN(C1CCS(=O)(=O)CC1)C(=O)CNC(=O)C=CC2=CC(=CC=C2)Cl,"['ML264', '1550008-55-3', '(E)-3-(3-chlorophenyl)-N-(2-((1,1-dioxidotetrahydro-2H-thiopyran-4-yl)(methyl)amino)-2-oxoethyl)acrylamide', 'ML-264', '2-Propenamide, 3-(3-chlorophenyl)-N-[2-[methyl(tetrahydro-1,1-dioxido-2H-thiopyran-4-yl)amino]-2-oxoethyl]-, (2E)-', '(E)-3-(3-chlorophenyl)-N-[2-[(1,1-dioxothian-4-yl)-methylamino]-2-oxoethyl]prop-2-enamide', 'CID-51003603', 'C17H21ClN2O4S', 'MLS003874889', 'CHEMBL4462423']"
126941,"(2S)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]pentanedioic acid",MTX,C20H22N8O5,454.4,CN(CC1=CN=C2C(=N1)C(=NC(=N2)N)N)C3=CC=C(C=C3)C(=O)NC(CCC(=O)O)C(=O)O,"['methotrexate', '59-05-2', 'Rheumatrex', 'Amethopterin', 'Methylaminopterin', 'Metatrexan', 'Hdmtx', 'Ledertrexate', 'Methylaminopterinum', 'MTX']"
3045381,"3-[3-[[(7S)-3,4-dimethoxy-7-bicyclo[4.2.0]octa-1,3,5-trienyl]methyl-methylamino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one;hydrochloride",Coralan,C27H37ClN2O5,505.0,CN(CCCN1CCC2=CC(=C(C=C2CC1=O)OC)OC)CC3CC4=CC(=C(C=C34)OC)OC.Cl,"['Ivabradine hydrochloride', '148849-67-6', 'Ivabradine HCl', 'UNII-TP19837BZK', 'TP19837BZK', '2H-3-Benzazepin-2-one, 3-[3-[[[(7S)-3,4-dimethoxybicyclo[4.2.0]octa-1,3,5-trien-7-yl]methyl]methylamino]propyl]-1,3,4,5-tetrahydro-7,8-dimethoxy-, hydrochloride (1:1)', 'DTXSID2046913', 'CHEBI:85969', 'AMG 998', 'AMG-998']"
77999,"5-[[4-[2-[methyl(pyridin-2-yl)amino]ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione",RGZ,C18H19N3O3S,357.4,CN(CCOC1=CC=C(C=C1)CC2C(=O)NC(=O)S2)C3=CC=CC=N3,"['rosiglitazone', '122320-73-4', 'Rosiglizole', 'Rezult', 'rosiglitazona', 'Gaudil', 'Rosvel', 'TDZ 01', 'rosiglitazonum', 'DTXSID7037131']"
54676228,"4-hydroxy-2-methyl-1,1-dioxo-N-pyridin-2-yl-1lambda6,2-benzothiazine-3-carboxamide",BAXO,C15H13N3O4S,331.3,CN1C(=C(C2=CC=CC=C2S1(=O)=O)O)C(=O)NC3=CC=CC=N3,"['piroxicam', '36322-90-4', 'Piroxicamum', 'Pyroxycam', 'Roxicam', 'Piroftal', 'BAXO', 'Rosiden', 'CHF 1251', '2H-1,2-Benzothiazine-3-carboxamide, 4-hydroxy-2-methyl-N-2-pyridinyl-, 1,1-dioxide']"
46208890,"1-N'-[2,5-difluoro-4-[2-(1-methylpyrazol-4-yl)pyridin-4-yl]oxyphenyl]-1-N-phenylcyclopropane-1,1-dicarboxamide",s8721,C26H21F2N5O3,489.5,CN1C=C(C=N1)C2=NC=CC(=C2)OC3=C(C=C(C(=C3)F)NC(=O)C4(CC4)C(=O)NC5=CC=CC=C5)F,"['1225278-16-9', 'c-Kit-IN-1', ""1-N'-[2,5-difluoro-4-[2-(1-methylpyrazol-4-yl)pyridin-4-yl]oxyphenyl]-1-N-phenylcyclopropane-1,1-dicarboxamide"", 'N-(2,5-Difluoro-4-((2-(1-methyl-1H-pyrazol-4-yl)pyridin-4-yl)oxy)phenyl)-N-phenylcyclopropane-1,1-dicarboxamide', ""N'1-(2,5-DIFLUORO-4-{[2-(1-METHYLPYRAZOL-4-YL)PYRIDIN-4-YL]OXY}PHENYL)-N1-PHENYLCYCLOPROPANE-1,1-DICARBOXAMIDE"", 'PDGFR inhibitor 1', 'SCHEMBL2450218', 'CHEMBL4303619', 'WWOXKWLDMLMYQY-UHFFFAOYSA-N', 'BCP05207']"
5327711,"3-(3-aminophenyl)-4-(1-methylindol-3-yl)pyrrole-2,5-dione",KROKUS,C19H15N3O2,317.3,CN1C=C(C2=CC=CC=C21)C3=C(C(=O)NC3=O)C4=CC(=CC=C4)N,"['IRON OXIDE, (SPENT)', 'IRON OXIDE, [SPENT]', 'alpha-iron oxide', 'alpha-ferric oxide', 'Iron oxide, spent', 'ABDOSCAN', 'COLLIRON', 'FERROBIONAT', 'KROKUS', 'LUXMASSE']"
44582816,"3-(5-fluoro-1-benzofuran-3-yl)-4-(5-methyl-[1,3]dioxolo[4,5-f]indol-7-yl)pyrrole-2,5-dione",s9602,C22H13FN2O5,404.3,CN1C=C(C2=CC3=C(C=C21)OCO3)C4=C(C(=O)NC4=O)C5=COC6=C5C=C(C=C6)F,"['9-ING-41', 'elraglusib', 'Elraglusib [USAN]', 'ND1SOF0DLU', 'UNII-ND1SOF0DLU', 'ELRAGLUSIB [INN]', '3-(5-fluoro-1-benzofuran-3-yl)-4-(5-methyl-[1,3]dioxolo[4,5-f]indol-7-yl)pyrrole-2,5-dione', '9 ing 41', 'Elraglusib (USAN)', 'compound 26 [PMID: 19338355]']"
10288191,6-(4-bromo-2-fluoroanilino)-7-fluoro-N-(2-hydroxyethoxy)-3-methylbenzimidazole-5-carboxamide,Mektovi,C17H15BrF2N4O3,441.2,CN1C=NC2=C1C=C(C(=C2F)NC3=C(C=C(C=C3)Br)F)C(=O)NOCCO,"['Binimetinib', 'MEK162', 'Mektovi', 'ARRY-162', 'ARRY-438162', '5-[(4-Bromo-2-fluorophenyl)amino]-4-fluoro-N-(2-hydroxyethoxy)-1-methyl-1H-benzimidazole-6-carboxamide', 'NVP-MEK162', 'binimetinibum', 'UNII-181R97MR71', '181R97MR71']"
24963252,"3-[(2R)-2,3-dihydroxypropyl]-6-fluoro-5-(2-fluoro-4-iodoanilino)-8-methylpyrido[2,3-d]pyrimidine-4,7-dione",IZG,C17H15F2IN4O4,504.23,CN1C2=C(C(=C(C1=O)F)NC3=C(C=C(C=C3)I)F)C(=O)N(C=N2)CC(CO)O,"['TAK-733', '1035555-63-5', 'TAK 733', '(R)-3-(2,3-dihydroxypropyl)-6-fluoro-5-(2-fluoro-4-iodophenylamino)-8-methylpyrido[2,3-d]pyrimidine-4,7(3H,8H)-dione', 'UNII-5J61HSP0QJ', 'Mek inhibitor tak-733', '3-[(2r)-2,3-Dihydroxypropyl]-6-Fluoro-5-[(2-Fluoro-4-Iodophenyl)amino]-8-Methylpyrido[2,3-D]pyrimidine-4,7(3h,8h)-Dione', 'example 18 [US8470837]', 'REC-4881', 'compound 17 [PMID: 21310613]']"
65628,4-[5-[bis(2-chloroethyl)amino]-1-methylbenzimidazol-2-yl]butanoic acid,Bendamustine,C16H21Cl2N3O2,358.3,CN1C2=C(C=C(C=C2)N(CCCl)CCCl)N=C1CCCC(=O)O,"['Bendamustine', '16506-27-7', 'Bendamustina', 'Bendamustinum', 'Bendamustinum [Latin]', 'UNII-9266D9P3PQ', 'DTXSID2046888', 'HSDB 7763', '9266D9P3PQ', 'DTXCID0026888']"
238053,3-benzhydryloxy-8-methyl-8-azabicyclo[3.2.1]octane;methanesulfonic acid,B5592,C22H29NO4S,403.5,CN1C2CCC1CC(C2)OC(C3=CC=CC=C3)C4=CC=CC=C4.CS(=O)(=O)O,"['Cogentin mesylate', 'Benztropine (mesylate)', '3-Diphenylmethoxytropane methanesulfonate', '102701-02-0', 'MLS000737056', '3-(Benzhydryloxy)-8-methyl-8-azabicyclo[3.2.1]octane methanesulfonate', 'NSC42199', 'Benzotropine mesylate', '3-(diphenylmethoxy)-8-methyl-8-azabicyclo[3.2.1]octane, methanesulfonic acid', 'SMR000394012']"
110635,"(2R,8R)-2-(1,3-benzodioxol-5-yl)-6-methyl-3,6,17-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1(10),11,13,15-tetraene-4,7-dione",CIA,C22H19N3O4,389.4,CN1CC(=O)N2C(C1=O)CC3=C(C2C4=CC5=C(C=C4)OCO5)NC6=CC=CC=C36,"['Tadalafil', '171596-29-5', 'ADCIRCA', 'ICOS 351', 'Tadalafilo', 'Tadalafil mylan', 'Trans-tadalafil', 'Tadalafil Lilly', 'GF 196960', 'HSDB 7303']"
3081361,N-(4-bromo-2-fluorophenyl)-6-methoxy-7-[(1-methylpiperidin-4-yl)methoxy]quinazolin-4-amine,Zactima,C22H24BrFN4O2,475.4,CN1CCC(CC1)COC2=C(C=C3C(=C2)N=CN=C3NC4=C(C=C(C=C4)Br)F)OC,"['Vandetanib', '443913-73-3', 'N-(4-Bromo-2-fluorophenyl)-6-methoxy-7-((1-methylpiperidin-4-yl)methoxy)quinazolin-4-amine', 'N-(4-bromo-2-fluorophenyl)-6-methoxy-7-[(1-methylpiperidin-4-yl)methoxy]quinazolin-4-amine', 'GNF-PF-2188', 'ZD-64', 'NSC-744325', 'NSC-760766', 'CHEBI:49960', 'UNII-YO460OQ37K']"
25166913,"1-[(2R,4R)-2-(1H-benzimidazol-2-yl)-1-methylpiperidin-4-yl]-3-(4-cyanophenyl)urea",Glasdegib,C21H22N6O,374.4,CN1CCC(CC1C2=NC3=CC=CC=C3N2)NC(=O)NC4=CC=C(C=C4)C#N,"['Glasdegib', 'PF-04449913', 'PF 04449913', 'glasdegibum', '1-[(2R,4R)-2-(1H-benzimidazol-2-yl)-1-methylpiperidin-4-yl]-3-(4-cyanophenyl)urea', 'UNII-K673DMO5H9', 'K673DMO5H9', 'PF-4449913', 'PF-913', 'CHEBI:145428']"
10143,"(6aS)-1,2,10-trimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-11-ol",Luteanin,C20H23NO4,341.4,CN1CCC2=CC(=C(C3=C2C1CC4=C3C(=C(C=C4)OC)O)OC)OC,"['Isocorydine', 'Artabotrin', 'Luteanin', 'Uzokoridin', 'd-Isocorydine', 'L-(+)-Isocorydine', 'S-(+)-Isocorydine', 'Luteanine', 'Lindcarpine, N,O-dimethyl-', 'Aporphin-11-ol, 1,2,10-trimethoxy-']"
275182,"(1S,14R)-20,21,25-trimethoxy-15,30-dimethyl-7,23-dioxa-15,30-diazaheptacyclo[22.6.2.23,6.18,12.114,18.027,31.022,33]hexatriaconta-3(36),4,6(35),8,10,12(34),18,20,22(33),24,26,31-dodecaen-9-ol",BERBAMINE,C37H40N2O6,608.7,CN1CCC2=CC(=C3C=C2C1CC4=CC=C(C=C4)OC5=C(C=CC(=C5)CC6C7=C(O3)C(=C(C=C7CCN6C)OC)OC)O)OC,"['BERBAMINE', '(+)-Berbamine', 'd-Berbamine', 'Berbenine', 'UNII-V5KM4XJ0WM', 'V5KM4XJ0WM', 'CCRIS 6538', 'BERBAMINE [MI]', 'EINECS 207-523-5', 'NSC 121842']"
16217067,"(1S,14R)-20,21,25-trimethoxy-15,30-dimethyl-7,23-dioxa-15,30-diazaheptacyclo[22.6.2.23,6.18,12.114,18.027,31.022,33]hexatriaconta-3(36),4,6(35),8,10,12(34),18,20,22(33),24,26,31-dodecaen-9-ol;dihydrochloride",s3609,C37H42Cl2N2O6,681.6,CN1CCC2=CC(=C3C=C2C1CC4=CC=C(C=C4)OC5=C(C=CC(=C5)CC6C7=C(O3)C(=C(C=C7CCN6C)OC)OC)O)OC.Cl.Cl,"['Berbamine dihydrochloride', '6078-17-7', 'K44OC6U989', 'UNII-K44OC6U989', ""Berbaman-12-ol, 6,6',7-trimethoxy-2,2'-dimethyl-, dihydrochloride"", ""16H-1,24:6,9-Dietheno-11,15-metheno-2H-pyrido(2',3':17,18)(1,11)dioxacycloeicosino(2,3,4-ij)isoquinolin-12-ol, 3,4,4a,5,16a,17,18,19-octahydro-21,22,26-trimethoxy-4,17-dimethyl-, hydrochloride (1:2), (4aS,16aR)-"", ""16H-1,24:6,9-Dietheno-11,15-metheno-2H-pyrido[2',3':17,18][1,11]dioxacycloeicosino[2,3,4-ij]isoquinolin-12-ol, 3,4,4a,5,16a,17,18,19-octahydro-21,22,26-trimethoxy-4,17-dimethyl-, hydrochloride (1:2), (4aS,16aR)-"", '623-510-0', 'Berbamine (dihydrochloride)', '(1S,14R)-20,21,25-trimethoxy-15,30-dimethyl-7,23-dioxa-15,30-diazaheptacyclo[22.6.2.23,6.18,12.114,18.027,31.022,33]hexatriaconta-3(36),4,6(35),8,10,12(34),18,20,22(33),24,26,31-dodecaen-9-ol;dihydrochloride']"
10206,"(14S,27R)-22,33-dimethoxy-13,28-dimethyl-2,5,7,20-tetraoxa-13,28-diazaoctacyclo[25.6.2.216,19.13,10.121,25.04,8.031,35.014,39]nonatriaconta-1(33),3(39),4(8),9,16(38),17,19(37),21,23,25(36),31,34-dodecaene",Cepharantin,C37H38N2O6,606.7,CN1CCC2=CC3=C(C4=C2C1CC5=CC=C(C=C5)OC6=C(C=CC(=C6)CC7C8=CC(=C(C=C8CCN7C)OC)O4)OC)OCO3,"['CEPHARANTHINE', '(+)-Cepharanthine', 'O-Methylcepharanoline', 'Cepharantin', 'Cepharanthine [JAN]', 'CCRIS 6539', ""6',12'-Dimethoxy-2,2'-dimethyl-6,7-(methylenebis(oxy))oxyacanthan"", 'Cepharanthine (TN)', 'NSC 623442', 'NSC-623442']"
5459308,"(1R,9S,10S)-3-hydroxy-4,12-dimethoxy-17-methyl-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5,11-tetraen-13-one",Kukoline,C19H23NO4,329.4,CN1CCC23CC(=O)C(=CC2C1CC4=C3C(=C(C=C4)OC)O)OC,"['Sinomenine', '115-53-7', 'Kukoline', 'Cucoline', 'Coculine', 'Sabianine A', 'CCRIS 1550', 'SINOMENIN', 'morphinan-6-one, 7,8-didehydro-4-hydroxy-3,7-dimethoxy-17-methyl-, (9alpha,13alpha,14alpha)-', 'EINECS 204-094-6']"
138611145,"2-[(2S)-4-[7-(8-chloronaphthalen-1-yl)-2-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-1-(2-fluoroprop-2-enoyl)piperazin-2-yl]acetonitrile",KRAZATI,C32H35ClFN7O2,604.1,CN1CCCC1COC2=NC3=C(CCN(C3)C4=CC=CC5=C4C(=CC=C5)Cl)C(=N2)N6CCN(C(C6)CC#N)C(=O)C(=C)F,"['MRTX849', 'Adagrasib', '2326521-71-3', 'MRTX-849', 'KRAZATI', 'Kras G12C inhibitor MRTX849', '8EOO6HQF8Y', '2-((S)-4-(7-(8-Chloronaphthalen-1-yl)-2-(((S)-1-methylpyrrolidin-2-yl)methoxy)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yl)-1-(2-fluoroacryloyl)piperazin-2-yl)acetonitrile', 'UNII-8EOO6HQF8Y', '2-Piperazineacetonitrile, 4-[7-(8-chloro-1-naphthalenyl)-5,6,7,8-tetrahydro-2-[[(2S)-1-methyl-2-pyrrolidinyl]methoxy]pyrido[3,4-d]pyrimidin-4-yl]-1-(2-fluoro-1-oxo-2-propen-1-yl)-, (2S)-']"
3578572,3-(4-methylpiperazine-1-carbonyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid,EMPM,C13H20N2O4,268.31,CN1CCN(CC1)C(=O)C2C3CCC(C2C(=O)O)O3,"['1026680-07-8', '(Rac)-LB-100', '3-(4-methylpiperazine-1-carbonyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid', 'EMPM', '2-(4-methylpiperazine-1-carbonyl)-7-oxabicyclo[2.2.1]heptane-3-carboxylic acid', 'CID 3578572', 'LB 1', 'AK-968/40946742', 'SCHEMBL2832350', '7-Oxabicyclo[2.2.1]heptane-2-carboxylic acid, 3-[(4-methyl-1-piperazinyl)carbonyl]-, (1R,2R,3S,4S)-rel-']"
25141092,"N-[5-[(3,5-difluorophenyl)methyl]-1H-indazol-3-yl]-4-(4-methylpiperazin-1-yl)-2-(oxan-4-ylamino)benzamide",YMX,C31H34F2N6O2,560.6,CN1CCN(CC1)C2=CC(=C(C=C2)C(=O)NC3=NNC4=C3C=C(C=C4)CC5=CC(=CC(=C5)F)F)NC6CCOCC6,"['Entrectinib', '1108743-60-7', 'Rozlytrek', 'RXDX-101', 'NMS-E628', 'entrectinibum', 'UNII-L5ORF0AN1I', 'L5ORF0AN1I', 'RXDX 101', 'Benzamide, N-(5-((3,5-difluorophenyl)methyl)-1H-indazol-3-yl)-4-(4-methyl-1-piperazinyl)-2-((tetrahydro-2H-pyran-4-yl)amino)-']"
10138980,3-amino-6-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-N-pyridin-3-ylpyrazine-2-carboxamide,GR9,C21H23N7O3S,453.5,CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C3=CN=C(C(=N3)C(=O)NC4=CN=CC=C4)N,"['AZD2858', '486424-20-8', 'AZD-2858', 'AZD 2858', '3-amino-6-(4-((4-methylpiperazin-1-yl)sulfonyl)phenyl)-N-(pyridin-3-yl)pyrazine-2-carboxamide', '3-amino-6-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-N-pyridin-3-ylpyrazine-2-carboxamide', '3-Amino-6-{4-[(4-Methylpiperazin-1-Yl)sulfonyl]phenyl}-N-Pyridin-3-Ylpyrazine-2-Carboxamide', 'CHEMBL2177161', '486424-20-8 (free base)', '3-amino-6-(4-(4-methylpiperazin-1-ylsulfonyl)phenyl)-N-(pyridin-3-yl)pyrazine-2-carboxamide']"
25145656,"2-fluoro-N-methyl-4-[7-(quinolin-6-ylmethyl)imidazo[1,2-b][1,2,4]triazin-2-yl]benzamide",s2788,C23H17FN6O,412.4,CNC(=O)C1=C(C=C(C=C1)C2=NN3C(=CN=C3N=C2)CC4=CC5=C(C=C4)N=CC=C5)F,"['capmatinib', '1029712-80-8', 'INCB28060', 'INC-280', '2-fluoro-N-methyl-4-(7-(quinolin-6-ylmethyl)imidazo[1,2-b][1,2,4]triazin-2-yl)benzamide', 'INCB-28060', 'NVP-INC280-NX', 'NVP-INC280', 'INCB-28060 FREE BASE', 'INCB 28060']"
24872560,"4-[7-[6-cyano-5-(trifluoromethyl)pyridin-3-yl]-8-oxo-6-sulfanylidene-5,7-diazaspiro[3.4]octan-5-yl]-2-fluoro-N-methylbenzamide",Erleada,C21H15F4N5O2S,477.4,CNC(=O)C1=C(C=C(C=C1)N2C(=S)N(C(=O)C23CCC3)C4=CC(=C(N=C4)C#N)C(F)(F)F)F,"['apalutamide', 'ARN-509', '956104-40-8', 'Erleada', 'ARN 509', 'JNJ-56021927', 'ARN509', 'apalutamida', 'UNII-4T36H88UA7', '4-(7-(6-CYANO-5-(TRIFLUOROMETHYL)PYRIDIN-3-YL)-8-OXO-6-THIOXO-5,7-DIAZASPIRO[3.4]OCTAN-5-YL)-2-FLUORO-N-METHYLBENZAMIDE']"
11167602,4-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-3-fluorophenoxy]-N-methylpyridine-2-carboxamide,Stivarga,C21H15ClF4N4O3,482.8,CNC(=O)C1=NC=CC(=C1)OC2=CC(=C(C=C2)NC(=O)NC3=CC(=C(C=C3)Cl)C(F)(F)F)F,"['Regorafenib', '755037-03-7', 'BAY 73-4506', 'Regorafenibum', 'BAY73-4506', 'BAY-73-4506', '4-[4-({[4-Chloro-3-(trifluoromethyl)phenyl]carbamoyl}amino)-3-fluorophenoxy]-N-methylpyridine-2-carboxamide', 'UNII-24T2A1DOYB', 'REGORAFENIB ANHYDROUS', '24T2A1DOYB']"
5284443,3-[(1R)-1-hydroxy-2-(methylamino)ethyl]phenol;hydrochloride,URI,C9H14ClNO2,203.66,CNCC(C1=CC(=CC=C1)O)O.Cl,"['PHENYLEPHRINE HYDROCHLORIDE', 'Phenylephrine HCl', 'Biomydrin', 'Mydfrin', 'Nostril', '(R)-Phenylephrine hydrochloride', 'Adrianol', 'Almefrin', 'Consdrin', 'Fenilfar']"
9931953,"6-fluoro-2-[4-(methylaminomethyl)phenyl]-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;phosphoric acid",s1098,C19H21FN3O5P,421.4,CNCC1=CC=C(C=C1)C2=C3CCNC(=O)C4=C3C(=CC(=C4)F)N2.OP(=O)(O)O,"['8-fluoro-5-(4-((methylamino)methyl)phenyl)-2,3,4,6-tetrahydro-1H-azepino[5,4,3-cd]indol-1-one phosphate', '8-fluoro-5-(4-((methylamino)methyl)phenyl)-2,3,4,6-tetrahydro-1H-azepino(5,4,3-cd)indol-1-one phosphate', '813-337-0', 'Rucaparib phosphate', '459868-92-9', 'AG-014699', 'PF-01367338', 'AG014699', 'AG 014699', 'Rucaparib (phosphate)']"
60606,"methyl (2S)-2-(2-chlorophenyl)-2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)acetate",CGE,C16H16ClNO2S,321.8,COC(=O)C(C1=CC=CC=C1Cl)N2CCC3=C(C2)C=CS3,"['clopidogrel', '113665-84-2', 'Zyllt', '(S)-Clopidogrel', 'Thrombo', '(+)-Clopidogrel', '(+)-(S)-Clopidogrel', 'Clopidogrel Winthrop', 'Clopidogrel 1A Pharma', 'HSDB 7430']"
637568,dimethyl (E)-but-2-enedioate,EOU,C6H8O4,144.12,COC(=O)C=CC(=O)OC,"['Dimethyl fumarate', '624-49-7', 'Dimethylfumarate', 'Methyl fumarate', 'Fumaric acid dimethyl ester', 'Fumaric acid, dimethyl ester', 'BG-12', 'Boletic acid dimethyl ester', 'Panaclar', 'Dimethyl trans-ethylenedicarboxylate']"
157921,methyl 5-amino-4-oxopentanoate;hydrochloride,Metvixia,C6H12ClNO3,181.62,COC(=O)CCC(=O)CN.Cl,"['Methyl 5-amino-4-oxopentanoate hydrochloride', '5-AMINOLEVULINIC ACID METHYL ESTER HYDROCHLORIDE', 'Methyl aminolevulinate hydrochloride', 'Methyl 5-Aminolevulinate Hydrochloride', 'Methyl aminolevulinate HCl', 'Metvix PDT', 'P-1202', 'Pentanoic acid, 5-amino-4-oxo-, methyl ester, hydrochloride', 'DTXSID4045630', 'UNII-7S73606O1A']"
4030,methyl N-(6-benzoyl-1H-benzimidazol-2-yl)carbamate,MBDZ,C16H13N3O3,295.29,COC(=O)NC1=NC2=C(N1)C=C(C=C2)C(=O)C3=CC=CC=C3,"['mebendazole', '31431-39-7', 'Pantelmin', 'Ovitelmin', 'Vermicidin', 'Vermirax', 'Mebenoazole', 'Mebutar', 'MBDZ', 'Besantin']"
5282230,"2-[[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]amino]benzoic acid",Rizaben,C18H17NO5,327.3,COC1=C(C=C(C=C1)C=CC(=O)NC2=CC=CC=C2C(=O)O)OC,"['tranilast', '53902-12-8', 'Rizaben', 'Tranilastum', 'MK 341', 'N-(3,4-Dimethoxycinnamoyl)anthranilic acid', 'Tranilastum [INN-Latin]', 'MK-341', 'Tranilast [USAN:INN:JAN]', 'SB-252218']"
123631,N-(3-chloro-4-fluorophenyl)-7-methoxy-6-(3-morpholin-4-ylpropoxy)quinazolin-4-amine,IRE,C22H24ClFN4O3,446.9,COC1=C(C=C2C(=C1)N=CN=C2NC3=CC(=C(C=C3)F)Cl)OCCCN4CCOCC4,"['Gefitinib', '184475-35-2', 'Irressat', 'ZD-1839', 'gefitinibum', 'CCRIS 9011', 'UNII-S65743JHBS', 'NSC-759856', 'S65743JHBS', 'DTXSID8041034']"
16735117,"N-(3-chloro-4-fluorophenyl)-6-[2-(5,8-dioxa-10-azadispiro[2.0.44.33]undecan-10-yl)ethoxy]-7-methoxyquinazolin-4-amine",Simotinib,C25H26ClFN4O4,500.9,COC1=C(C=C2C(=C1)N=CN=C2NC3=CC(=C(C=C3)F)Cl)OCCN4CC5(CC5)C6(C4)OCCO6,"['Simotinib', 'UNII-58K797D5IK', '58K797D5IK', 'SIM-6802', 'SIM6802', 'SIM 6802', 'AL6802', 'AL 6802', '4-QUINAZOLINAMINE, N-(3-CHLORO-4-FLUOROPHENYL)-6-(2-(5,8-DIOXA-10-AZADISPIRO(2.0.4.3)UNDEC-10-YL)ETHOXY)-7-METHOXY-', 'N-(3-chloro-4-fluorophenyl)-6-[2-(5,8-dioxa-10-azadispiro[2.0.4^{4}.3^{3}]undecan-10-yl)ethoxy]-7-methoxyquinazolin-4-amine']"
66065,"(2R,3S,4S,4aR,10bS)-3,4,8,10-tetrahydroxy-2-(hydroxymethyl)-9-methoxy-3,4,4a,10b-tetrahydro-2H-pyrano[3,2-c]isochromen-6-one",Cuscutin,C14H16O9,328.27,COC1=C(C=C2C(=C1O)C3C(C(C(C(O3)CO)O)O)OC2=O)O,"['bergenin', '477-90-7', 'Bergenin [JAN]', 'Yanbaicaisu', 'Bergeninum', 'L84RBE4IDC', 'Bergenin (JAN)', 'BERGENIN [MI]', 'BERGENINUM [CHP]', 'BERGENIN [WHO-DD]']"
445858,(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid,Ferulicacid,C10H10O4,194.18,COC1=C(C=CC(=C1)C=CC(=O)O)O,"['ferulic acid', 'trans-Ferulic Acid', '1135-24-6', '537-98-4', '4-Hydroxy-3-methoxycinnamic acid', 'trans-4-Hydroxy-3-methoxycinnamic acid', '(E)-Ferulic acid', '3-(4-Hydroxy-3-methoxyphenyl)acrylic acid', 'Coniferic acid', '3-(4-Hydroxy-3-methoxyphenyl)-2-propenoic acid']"
2179,N-[4-(acridin-9-ylamino)-3-methoxyphenyl]methanesulfonamide,ASW,C21H19N3O3S,393.5,COC1=C(C=CC(=C1)NS(=O)(=O)C)NC2=C3C=CC=CC3=NC4=CC=CC=C42,"['amsacrine', '51264-14-3', 'Amsidine', 'm-AMSA', 'Amsidyl', 'Acridinylanisidide', 'Amsacrina', 'Lamasine', 'Amekrin', 'mAMSA']"
73442,"2,3,9,10-tetramethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium;chloride",Fibrauretin,C21H22ClNO4,387.9,COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC(=C(C=C4CC3)OC)OC)OC.[Cl-],"['Palmatine chloride', '10605-02-4', 'Fibrauretin', 'ZJ6W8881Z8', 'NSC 209407', 'NSC-209407', 'Dibenzo[a,g]quinolizinium, 5,6-dihydro-2,3,9,10-tetramethoxy-, chloride', '2,3,9,10-tetramethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium;chloride', 'PALMATINE CHLORIDE [USP-RS]', 'PALMATINE CHLORIDE [WHO-DD]']"
155074,"16,17-dimethoxy-5,7-dioxa-13-azoniapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-1(13),2,4(8),9,14,16,18,20-octaene;chloride;hydrate",D78345,C20H20ClNO5,389.8,COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC5=C(C=C4CC3)OCO5)OC.O.[Cl-],"['68030-18-2', 'Benzo(g)-1,3-benzodioxolo(5,6-a)quinolizinium, 5,6-dihydro-9,10-dimethoxy-, chloride, monohydrate', 'Berberine chloride hydrate', '141433-60-5', '9,10-dimethoxy-5,6-dihydro-[1,3]dioxolo[4,5-g]isoquinolino[3,2-a]isoquinolin-7-ium chloride hydrate', 'Natural Yellow 18', 'Berberine (chloride hydrate)', 'Natural Yellow 18 chloride hydrate', '16,17-dimethoxy-5,7-dioxa-13-azoniapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-1(13),2,4(8),9,14,16,18,20-octaene;chloride;hydrate', 'Berberine chloride xhydrate']"
71621331,"1-[(3S)-3-[4-amino-3-[2-(3,5-dimethoxyphenyl)ethynyl]pyrazolo[3,4-d]pyrimidin-1-yl]pyrrolidin-1-yl]prop-2-en-1-one",Lytgobi,C22H22N6O3,418.4,COC1=CC(=CC(=C1)C#CC2=NN(C3=NC=NC(=C23)N)C4CCN(C4)C(=O)C=C)OC,"['Futibatinib', 'TAS-120', '1448169-71-8', 'Lytgobi', 'TAS120', 'UNII-4B93MGE4AL', '4B93MGE4AL', 'TAS 120', '2-Propen-1-one, 1-((3S)-3-(4-amino-3-(2-(3,5-dimethoxyphenyl)ethynyl)-1H-pyrazolo(3,4-d)pyrimidin-1-yl)-1-pyrrolidinyl)-', 'Example 2 (WO2013108809)']"
2359994,(2-chlorophenothiazin-10-yl)-(4-methoxyphenyl)methanone,iHAP1,C20H14ClNO2S,367.8,COC1=CC=C(C=C1)C(=O)N2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl,"['105925-39-1', '2-chloro-10-(4-methoxybenzoyl)-10H-phenothiazine', '855-169-0', 'Tubulin inhibitor 6', 'iHAP1', '(2-Chloro-10H-phenothiazin-10-yl)(4-methoxyphenyl)methanone', 'CHEMBL1801816', '(2-chlorophenothiazin-10-yl)-(4-methoxyphenyl)methanone', 'Tubulin inhibitor 6?', 'Oprea1_789892']"
2194,5-(4-methoxyphenyl)dithiole-3-thione,Halpen,C10H8OS3,240.4,COC1=CC=C(C=C1)C2=CC(=S)SS2,"['Anethole trithione', '532-11-6', 'anetholtrithion', '5-(4-Methoxyphenyl)-3H-1,2-dithiole-3-thione', 'Sulfarlem', 'Tiopropen', 'Halpen', 'Trithioanethole', 'Felviten', 'Sulfogal']"
25102846,"1-N-[4-(6,7-dimethoxyquinolin-4-yl)oxyphenyl]-1-N'-(4-fluorophenyl)cyclopropane-1,1-dicarboxamide;(2S)-2-hydroxybutanedioic acid",Cometriq,C32H30FN3O10,635.6,COC1=CC2=C(C=CN=C2C=C1OC)OC3=CC=C(C=C3)NC(=O)C4(CC4)C(=O)NC5=CC=C(C=C5)F.C(C(C(=O)O)O)C(=O)O,"['Cabozantinib S-malate', '1140909-48-3', 'Cabozantinib malate', 'cabozantinib (S)-malate', 'Cabometyx', 'cabozantinib L-malate', 'UNII-DR7ST46X58', 'BMS907351', 'DR7ST46X58', 'CHEBI:72319']"
5324346,2-[(E)-[5-methoxy-1-[4-(trifluoromethyl)phenyl]pentylidene]amino]oxyethanamine,FVX,C15H21F3N2O2,318.33,COCCCCC(=NOCCN)C1=CC=C(C=C1)C(F)(F)F,"['fluvoxamine', '54739-18-3', 'Fluvoxamina', 'Fluvoxaminum', 'Fluvoxaminum [INN-Latin]', 'Fluvoxamina [INN-Spanish]', 'UNII-O4L1XPO44W', 'O4L1XPO44W', 'CHEBI:5138', 'DTXSID2044002']"
9560989,(Z)-but-2-enedioic acid;2-[(E)-[5-methoxy-1-[4-(trifluoromethyl)phenyl]pentylidene]amino]oxyethanamine,Luvox,C19H25F3N2O6,434.4,COCCCCC(=NOCCN)C1=CC=C(C=C1)C(F)(F)F.C(=CC(=O)O)C(=O)O,"['FLUVOXAMINE MALEATE', '61718-82-9', 'Fevarin', 'Faverin', 'Luvox CR', 'Fluvoxamine hydrogenmaleate', 'SME 3110', 'UNII-5LGN83G74V', 'NSC-759602', '5LGN83G74V']"
176870,"N-(3-ethynylphenyl)-6,7-bis(2-methoxyethoxy)quinazolin-4-amine",Tarceva,C22H23N3O4,393.4,COCCOC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC=CC(=C3)C#C)OCCOC,"['Erlotinib', '183321-74-6', 'N-(3-Ethynylphenyl)-6,7-bis(2-methoxyethoxy)quinazolin-4-amine', '4-Quinazolinamine, N-(3-ethynylphenyl)-6,7-bis(2-methoxyethoxy)-', 'erlotinibum', 'N-(3-Ethynylphenyl)-6,7-bis(2-methoxyethoxy)-4-quinazolinamine', 'UNII-J4T82NDH7E', 'J4T82NDH7E', 'DTXSID8046454', 'HSDB 8082']"
117947097,"3-[[(1S,2S,3R)-2,3-difluoro-1-hydroxy-7-methylsulfonyl-2,3-dihydro-1H-inden-4-yl]oxy]-5-fluorobenzonitrile",Welireg,C17H12F3NO4S,383.3,CS(=O)(=O)C1=C2C(C(C(C2=C(C=C1)OC3=CC(=CC(=C3)C#N)F)F)F)O,"['Belzutifan', '1672668-24-4', 'PT2977', 'Welireg', 'MK-6482', 'MK6482', 'PT-2977', '7K28NB895L', 'UNII-7K28NB895L', 'Pt 2977']"
24776445,2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-methylsulfonylbenzamide,VIS,C19H14Cl2N2O3S,421.3,CS(=O)(=O)C1=CC(=C(C=C1)C(=O)NC2=CC(=C(C=C2)Cl)C3=CC=CC=N3)Cl,"['Vismodegib', '879085-55-9', 'GDC-0449', 'Erivedge', '2-chloro-N-(4-chloro-3-(pyridin-2-yl)phenyl)-4-(methylsulfonyl)benzamide', 'GDC0449', 'GDC 0449', 'vismodegibum', 'NSC-747691', 'NSC 747691']"
4495,N-(4-nitro-2-phenoxyphenyl)methanesulfonamide,NIM,C13H12N2O5S,308.31,CS(=O)(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])OC2=CC=CC=C2,"['nimesulide', '51803-78-2', 'N-(4-Nitro-2-phenoxyphenyl)methanesulfonamide', 'Mesulid', 'Flogovital', 'Sulidene', 'Nimed', 'Methanesulfonamide, N-(4-nitro-2-phenoxyphenyl)-', 'Nimesulida', '4-NITRO-2-PHENOXYMETHANESULFONANILIDE']"
5311180,(6-carbamimidoylnaphthalen-2-yl) 4-(diaminomethylideneamino)benzoate;methanesulfonic acid,Futhan,C21H25N5O8S2,539.6,CS(=O)(=O)O.CS(=O)(=O)O.C1=CC(=CC=C1C(=O)OC2=CC3=C(C=C2)C=C(C=C3)C(=N)N)N=C(N)N,"['Nafamostat mesylate', '82956-11-4', 'nafamostat mesilate', 'FUT-175', 'Nafamstat Mesilate', 'Ronastat', 'Nafamostat mesylate [USAN]', 'Ronastat (TN)', 'Nafamostat dimethanesulfonate', 'Nafamostat mesylate (USAN)']"
2478,4-methylsulfonyloxybutyl methanesulfonate,BUS,C6H14O6S2,246.3,CS(=O)(=O)OCCCCOS(=O)(=O)C,"['busulfan', '55-98-1', 'Myleran', 'Busulphan', 'Leucosulfan', 'Myeloleukon', 'Mielucin', 'Misulban', 'Sulfabutin', '1,4-BUTANEDIOL DIMETHANESULFONATE']"
10114,"(2S,4aS,6aR,6aS,6bR,8aR,10S,12aS,14bR)-10-hydroxy-2,4a,6a,6b,9,9,12a-heptamethyl-13-oxo-3,4,5,6,6a,7,8,8a,10,11,12,14b-dodecahydro-1H-picene-2-carboxylic acid",CBW,C30H46O4,470.7,CC1(C2CCC3(C(C2(CCC1O)C)C(=O)C=C4C3(CCC5(C4CC(CC5)(C)C(=O)O)C)C)C)C,"['enoxolone', '471-53-4', 'Glycyrrhetic acid', 'GLYCYRRHETINIC ACID', 'Uralenic acid', '18-beta-Glycyrrhetinic acid', '18beta-Glycyrrhetinic acid', 'Rhetinic Acid', 'Enoxolona', 'Biosone']"
5282451,"calcium;(E,3R,5S)-7-[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]-3,5-dihydroxyhept-6-enoate",Livalo,C50H46CaF2N2O8,881.0,C1CC1C2=NC3=CC=CC=C3C(=C2C=CC(CC(CC(=O)[O-])O)O)C4=CC=C(C=C4)F.C1CC1C2=NC3=CC=CC=C3C(=C2C=CC(CC(CC(=O)[O-])O)O)C4=CC=C(C=C4)F.[Ca+2],"['Pitavastatin calcium', '147526-32-7', 'Pitavastatin hemicalcium', 'Livalo', 'Itavastatin calcium', 'Pitavastatin calcium salt', 'Flovas', 'UNII-IYD54XEG3W', 'IYD54XEG3W', 'NK 104 (acid)']"
441074,"(S)-[(2R,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol",QDN,C20H24N2O2,324.4,COC1=CC2=C(C=CN=C2C=C1)C(C3CC4CCN3CC4C=C)O,"['quinidine', '56-54-2', '(+)-Quinidine', 'Conquinine', 'Pitayine', 'Chinidin', 'Conchinin', '(8R,9S)-Quinidine', ""(9S)-6'-Methoxycinchonan-9-ol"", 'beta-Quinine']"
24997615,"(2S,3R,4R,5S,6R)-2-[3-[[5-(4-fluorophenyl)thiophen-2-yl]methyl]-4-methylphenyl]-6-(hydroxymethyl)oxane-3,4,5-triol;hydrate",Invokana,C48H52F2O11S2,907.0,CC1=C(C=C(C=C1)C2C(C(C(C(O2)CO)O)O)O)CC3=CC=C(S3)C4=CC=C(C=C4)F.CC1=C(C=C(C=C1)C2C(C(C(C(O2)CO)O)O)O)CC3=CC=C(S3)C4=CC=C(C=C4)F.O,"['928672-86-0', 'Canagliflozin hydrate', 'CHEBI:73272', 'Canagliflozin (USAN/INN)', 'Canagliflozin hydrate (JAN)', 'CANAGLIFLOZIN HYDRATE [JAN]', '(1S)-1,5-anhydro-1-(3-{[5-(4-fluorophenyl)-2-thienyl]methyl}-4-methylphenyl)-D-glucitol--water (2/1)', '(1S)-1,5-anhydro-1-(3-((5-(4-fluorophenyl)-2-thienyl)methyl)-4-methylphenyl)-D-glucitol--water (2/1)', 'canagliflozin hemihydrate', 'Invokana']"
78357807,N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[[4-(1-methylindol-3-yl)pyrimidin-2-yl]amino]phenyl]prop-2-enamide;methanesulfonic acid,Tagrisso,C29H37N7O5S,595.7,CN1C=C(C2=CC=CC=C21)C3=NC(=NC=C3)NC4=C(C=C(C(=C4)NC(=O)C=C)N(C)CCN(C)C)OC.CS(=O)(=O)O,"['Osimertinib mesylate', 'AZD-9291 mesylate', 'AZD9291 mesylate', 'Mereletinib mesylate', 'Mereletinib mesilate', 'UNII-RDL94R2A16', 'RDL94R2A16', 'osimertinib monomesylate', 'osimertinib methanesulfonate', 'CHEBI:90948']"
5282164,"[(1S,3R,6S,8R,11S,12S,15R,16R)-7,7,12,16-tetramethyl-15-[(2R)-6-methylhept-5-en-2-yl]-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl] (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate",OZ,C40H58O4,602.9,CC(CCC=C(C)C)C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(C5(C)C)OC(=O)C=CC6=CC(=C(C=C6)O)OC)C)C,"['gamma-Oryzanol', 'Cycloartenyl ferulate', 'gamma Oryzanol', '11042-64-1', 'Gammariza', 'Oliver', 'gamma-Orizanol', 'Gamma oryzanol [JAN]', 'Cycloartenol Trans-Ferulate', '21238-33-5']"