smiles
stringlengths 28
59
|
|---|
Cc1nonc1C(=O)CN1CCCC(Nc2ccccc2)C1 |
CN(C)CC(=O)NC1CC(NC(=O)Cn2ccnn2)C12CCC2 |
Cc1cocc1C(=O)N1CC(NC(=O)C2CCOC(C)(C)C2)C1 |
CC1CC(C(=O)N2CCC(NC(=O)c3coc(CO)c3)CC2)C1 |
CN(CC(O)CNC(=O)c1cscn1)C(=O)C1C2COCC21 |
O=C(NCCC1CC(NC(=O)c2c[nH]c(=O)s2)C1)c1cc[nH]c1 |
O=C(NC1(C2CN(C(=O)C3(N4CCCC4)CC3)C2)CC1)C(F)F |
Cc1ccccc1C(CO)N(C)C(=O)Nc1cc(C#N)cnn1 |
CC1=C(C(=O)N2CC(O)(CCNC(=O)c3cnns3)C2)CCC1 |
CN1CCN(Cc2ccc(NC(=O)CC3(C)CCN3)cc2)CC1 |
CCc1nc(C)oc1C(=O)N1CC(NC(=O)C2(CO)CCC2)C1 |
CCN(C(=O)c1ccc(Cl)o1)C(C)CNC(=O)c1c[nH]c(C)n1 |
Cc1nc(CC(=O)N2CCN(C(=O)C3CCO3)CC2CO)c[nH]1 |
CC1CCC1C(=O)NC1(C)CN(C(=O)c2ccoc2C2CC2)C1 |
CCC(=O)N1CC2CCOC2(CNC(=O)c2cc(C)c(C)[nH]2)C1 |
CC1(C(=O)NC2CCCC2NC(=O)CSC2CC2)COC(=O)C1 |
CCC(=O)N1CCCOC(CNC(=O)C2C3CNC(=O)C32)C1 |
CC(=O)N1CC(O)(CCNC(=O)c2ccc3c(C)noc3c2)C1 |
O=C(CN1CCC(C(=O)O)CC1)NCc1nc(C2CC2)cs1 |
O=C(Cc1ccsn1)NC1CCCCN(C(=O)c2c[nH]cn2)C1 |
O=C(NC1CCCCN(C(=O)C23CCC2C3)C1)c1c[nH]nn1 |
CCCC(=O)NC1CC2CC1N(C(=O)c1nonc1CC)C2 |
CC1(CNC(=O)CN2CC3CCC2CN3)CCC(F)(F)CC1 |
CCC(CN(C)C(=O)C1CC1(C)C)NC(=O)C1CCC(=O)O1 |
Cc1cc(CN(C)C(=O)C2CC3(C2)CC(c2nn[nH]n2)C3)no1 |
CN(CC(=O)N1CCC(NC(=O)C2CC2)C(F)C1)S(C)(=O)=O |
CCC1=NOC(C(=O)NCC2CN(C(=O)C3(OC)CC3)C2)C1 |
CC(C)OCC(=O)N1CCCCC(NC(=O)C2CCC2(C)C)C1 |
CC(C)n1ncc(C(=O)OCc2ccc(C(N)=O)cc2F)c1N |
O=C(NCC1CN(C(=O)C2CCC2)CCO1)c1ccncc1Cl |
Cn1cc(C(=O)N2CCC(CCNC(=O)CO)CC2)ncc1=O |
COc1oc(C)nc1C(=O)NC(C)CNC(=O)C1=CCCS1 |
CC(C)CC(F)(F)C(=O)N1CC(CNC(=O)C2CCCCC2)C1 |
CC1(C)CC2(CC2C(=O)NCC(O)CNC(=O)C2(C)CC2)C1 |
CCN1CCN(S(=O)(=O)N2CCCCC2CC2CCC2)CC1 |
Cc1cc(C)c(C(=O)O)cc1NC(=O)Cc1c[nH]cnc1=O |
CC(C)CC(F)(F)C(=O)NC1=CS(=O)(=O)N(C)c2ccccc21 |
CC1CC(NC(=O)Cc2c[nH]cnc2=O)CN(C(=O)CCF)C1 |
CCC(CC(=O)N1CCN(C(=O)c2cccs2)CC1CO)OC |
NC1CCN(C(=O)C2CCN(S(=O)(=O)c3c[nH]cn3)CC2)CC1 |
CC1(C)CCC(C(=O)NC2CN(C(=O)c3cncs3)CC2F)C1 |
Cc1cc(S(=O)(=O)NC(C(=O)O)c2cc(F)cc(F)c2)cs1 |
CS(=O)(CC1CC(O)C1)=NC(=O)c1cc(-c2ccccn2)no1 |
COCC(C)(C)C(=O)NC1CC2CN(C(=O)CCC#N)CC2C1 |
CC(C)OC1(C(=O)NC2CC2NC(=O)c2cncnc2)CCC1 |
Nc1cccn(CC(=O)Nc2ccc(Cl)c(CO)c2Cl)c1=O |
CC1=C(C(=O)NC2CCCN(C(=O)CC[S+](C)[O-])C2)CCCO1 |
O=C(CCC(F)F)N1CCC1CNC(=O)C12CCCC1C2(F)F |
CCN1C(=O)CCC1C(=O)NC1CN(C(=O)CCC(C)(C)C)C1 |
COC1CC(NC(=O)NCc2ccsc2S(N)(=O)=O)C1(C)C |
Cc1cccnc1C(=O)N1CC2C(CNC(=O)CN(C)C)C2C1 |
CCC(CNC(=O)c1ccoc1C(F)(F)F)NC(=O)C1CCO1 |
CN1C(NC2CC3(CNC(=O)C3)C2)=NCC1c1ccc(F)cc1 |
Cc1ccc(CC(=O)NC(C)CNC(=O)c2cn(C)c(C)n2)o1 |
CC(C)(F)CCC(=O)N1CC(CO)C2(C1)CN(C(=O)C(F)F)C2 |
NC(=O)C1CCC(C(=O)Nc2cc(F)c(Cl)c(C(=O)O)c2)C1 |
COc1cc(C(=O)N(C)C2CN(C(=O)C3(O)CCC3)C2)ccn1 |
CCOC(C)C(=O)NC1C2CC1CN(C(=O)C1CCSCC1)C2 |
CCSC(C)C(=O)N1CCCC(C)(CNC(=O)C2CCC2)C1 |
COC(C)(C(=O)NC1CCN(C(=O)C2(F)CC2)CC1)C(C)C |
N#CCCC(=O)NC1C2CN(C(=O)CCc3c[nH]cn3)CC21 |
CC(CF)C(=O)NC1CCC(NC(=O)Cn2ncccc2=O)C1 |
CN(CC1CCCN(C(=O)C2CCC2)C1)C(=O)CSC(F)F |
O=C(NC1CCN(C(=O)C2CCO2)CC1)C1CCC2CC1CO2 |
O=C(C1CNCC2(CCC2)C1)N1CCC2(CC1)CS(=O)(=O)C2 |
CCn1cc(-c2cn(C(C)C(=O)NC(C)C3CCC3)nn2)cn1 |
O=C(CC1CCOCC1)NC1(C2CC2)CCN(C(=O)C2CC2)C1 |
CC(=O)N1CCC(C2CN(C(=O)C3CC(C)(C)CO3)C2)CC1 |
COc1nc(C)ccc1C(=O)NCc1nc(C(C)(F)F)cs1 |
Cc1[nH]cnc1CC(=O)NCC1CCCC(NC(=O)CC#N)C1 |
NC(=O)c1cc(C(=O)OCc2ccc(SC(F)F)cc2)ccn1 |
COCC1CC1C(=O)N1CCC(C)(NC(=O)C2CC2(C)C)C1 |
Cc1ccc(C(=O)NC(C)(C)CNC(=O)c2c[nH]cn2)c(Cl)c1 |
CCOc1ccc(F)c(C(=O)NC23CC(COC)(C2)C3)c1F |
CSCC(C)C(=O)N1CCC1CNC(=O)C1(O)CCOCC1 |
COc1cc(F)ccc1CCNC(=O)Nc1nonc1C#N |
Cc1nn(C2CCS(=O)(=O)C2)c(C)c1NC(=O)N1CCNCC1 |
Cc1nn(C)c(CN2CC(N3CCCNC3=O)C2)c1S(N)(=O)=O |
CCCc1nn(C)c(C(N)=O)c1NC(=O)C1CNCC12CCC2 |
CC(O)c1cn(CCC(=O)NC2(c3cccc(F)c3)CC2)nn1 |
Cc1cc(C(=O)N2CC3CN(C(=O)C4CC4)CC3C2)cnn1 |
CCOCc1cn(C2CCN(C(=O)c3cc(Cl)cs3)C2)nn1 |
CC(=O)N1CCC(NC(=O)c2csc(Cl)n2)(c2ccccc2)C1 |
CC1(CC(=O)N2CCC(O)(CNC(=O)c3ccccn3)C2)CC1 |
CC(C)(O)CC(=O)N1CCN(C(=O)c2cn3c(n2)SCC3)CC1 |
CC(=O)N1CCN(C2CCN(C(=O)CCC(C)(F)F)C2)CC1 |
CC1CCC(C(=O)N2CC(CO)(NC(=O)C3CCC3)C2)CC1 |
O=C(NC1CN(C(=O)c2ccco2)CC1F)c1cccnc1 |
CC(=O)N1CC(NC(=O)c2cn(C)c3ccccc23)CC1CO |
CC(C(=O)NCC1(NC(=O)C2CCCCO2)CC1)c1ncco1 |
CC(C)C(=O)NC1CN(C(=O)C2CN(C)C2)CC1C(F)(F)F |
CC1(NC(=O)CC2(C3CC3)CC2)CC(NC(=O)C2CCCO2)C1 |
CCC(C#N)C(=O)NCC(C)(C)NC(=O)c1nc(C)ccc1F |
CC[S+]([O-])CC(=O)N1CC2(C1)CN(C(=O)C1(C)CC(F)C1)C2 |
CCOCC(=O)NC1CCCC(NC(=O)c2nn(C)cc2N)C1 |
NCC1(O)CCCN(C(=O)C2CC2c2ccc3c(c2)OCO3)C1 |
CC(=O)N1CCC2(CCCC2NC(=O)c2cncc(CO)c2)C1 |
COCC(C)(C)CC(=O)N(C)C1CCCN(C(=O)C(C)C#N)C1 |
CC1C(NC(=O)C2CCCCC2O)CCN1C(=O)c1cc[nH]n1 |
CC(OC(=O)c1cn(C)c(=O)cn1)C(=O)Nc1ccc(Cl)cc1 |
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