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stringlengths 109
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stringlengths 109
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The compound with the SMILES of O(C(=O)C1[NH2+]CC2(C1)c1c(NC2=O)cccc1)C1CCN(CC1)C(=O)C shows no inhibition of the human beta-secretase 1 (BACE-1). | The compound with the SMILES of O(C(=O)C1[NH2+]CC2(C1)c1c(NC2=O)cccc1)C1CCN(CC1)C(=O)C shows no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
|
The chemical with the SMILES of Clc1cc2nc(n(c2cc1)C(CC(=O)NC(C(=O)[O-])COC(C)(C)C)CC)N shows no inhibition of the human beta-secretase 1 (BACE-1). | The chemical with the SMILES of Clc1cc2nc(n(c2cc1)C(CC(=O)NC(C(=O)[O-])COC(C)(C)C)CC)N shows no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
|
The chemical with the SMILES of Clc1cc2nc(n(c2cc1)C(CC(=O)NCCC(C)(C)C)CC)N exhibits no inhibition of the human beta-secretase 1 (BACE-1). | The chemical with the SMILES of Clc1cc2nc(n(c2cc1)C(CC(=O)NCCC(C)(C)C)CC)N exhibits no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
|
The compound with the SMILES of S1(=O)(=O)NCC2(N1c1cc(F)ccc1)CC([NH+](CC2)Cc1cc(OC)ccc1)C exhibits no inhibition of the human beta-secretase 1 (BACE-1). | The compound with the SMILES of S1(=O)(=O)NCC2(N1c1cc(F)ccc1)CC([NH+](CC2)Cc1cc(OC)ccc1)C exhibits no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
|
The compound with the SMILES of S(=O)(=O)(N(C)c1cc(cc(c1)C(OCC([NH2+]C)(Cc1ccccc1)CO)=O)C(=O)NC(C)c1ccc(F)cc1)C exhibits no inhibition of the human beta-secretase 1 (BACE-1). | The compound with the SMILES of S(=O)(=O)(N(C)c1cc(cc(c1)C(OCC([NH2+]C)(Cc1ccccc1)CO)=O)C(=O)NC(C)c1ccc(F)cc1)C exhibits no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
|
The compound with the SMILES of S(=O)(=O)(N(C)c1cc(cc(NCCC([NH3+])(Cc2ccccc2)CO)c1)C(=O)NC(C)c1ccc(F)cc1)C exhibits no inhibition of the human beta-secretase 1 (BACE-1). | The compound with the SMILES of S(=O)(=O)(N(C)c1cc(cc(NCCC([NH3+])(Cc2ccccc2)CO)c1)C(=O)NC(C)c1ccc(F)cc1)C exhibits no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
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The chemical with the SMILES of S(CCC([NH3+])(Cc1ccccc1)CO)c1cc(cc(N(S(=O)(=O)C)C)c1)C(=O)NC(C)c1ccc(F)cc1 shows no inhibition of the human beta-secretase 1 (BACE-1). | The chemical with the SMILES of S(CCC([NH3+])(Cc1ccccc1)CO)c1cc(cc(N(S(=O)(=O)C)C)c1)C(=O)NC(C)c1ccc(F)cc1 shows no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
|
The compound with the SMILES of O(C)c1cc(ccc1)C(=O)NCC(O)C(NC(=O)c1c2cccnc2n(c1)C(=O)N(CCCC)C)Cc1ccccc1 exhibits no inhibition of the human beta-secretase 1 (BACE-1). | The compound with the SMILES of O(C)c1cc(ccc1)C(=O)NCC(O)C(NC(=O)c1c2cccnc2n(c1)C(=O)N(CCCC)C)Cc1ccccc1 exhibits no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
|
The chemical with the SMILES of S(=O)(=O)(NCC(O)C(NC(=O)c1c2cccnc2n(c1)C(=O)N(CCCC)C)Cc1ccccc1)c1cc(OC)ccc1 shows no inhibition of the human beta-secretase 1 (BACE-1). | The chemical with the SMILES of S(=O)(=O)(NCC(O)C(NC(=O)c1c2cccnc2n(c1)C(=O)N(CCCC)C)Cc1ccccc1)c1cc(OC)ccc1 shows no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
|
The compound with the SMILES of OC(C(NC(=O)c1c2cccnc2n(c1)C(=O)N(CCCC)C)Cc1ccccc1)C[NH2+]C1CC1 exhibits no inhibition of the human beta-secretase 1 (BACE-1). | The compound with the SMILES of OC(C(NC(=O)c1c2cccnc2n(c1)C(=O)N(CCCC)C)Cc1ccccc1)C[NH2+]C1CC1 exhibits no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
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The compound with the SMILES of Brc1cc(ccc1O)CC1CS(=O)(=O)CC([NH3+])C1O shows no inhibition of the human beta-secretase 1 (BACE-1). | The compound with the SMILES of Brc1cc(ccc1O)CC1CS(=O)(=O)CC([NH3+])C1O shows no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
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The chemical with the SMILES of n1cc(ccc1)-c1cc(ccc1)C1(N=C(C(C)C)C(=N1)N)C displays no inhibition of the human beta-secretase 1 (BACE-1). | The chemical with the SMILES of n1cc(ccc1)-c1cc(ccc1)C1(N=C(C(C)C)C(=N1)N)C displays no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
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The chemical with the SMILES of O=C1N(C)C(=NC(C1)(C)[C@H]1C[C@@H]1c1ccccc1)N exhibits no inhibition of the human beta-secretase 1 (BACE-1). | The chemical with the SMILES of O=C1N(C)C(=NC(C1)(C)[C@H]1C[C@@H]1c1ccccc1)N exhibits no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
|
The chemical with the SMILES of Clc1cc2CC(N=C(NC(Cc3ccccc3)c3ncccn3)c2cc1)(C)C exhibits no inhibition of the human beta-secretase 1 (BACE-1). | The chemical with the SMILES of Clc1cc2CC(N=C(NC(Cc3ccccc3)c3ncccn3)c2cc1)(C)C exhibits no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
|
The chemical with the SMILES of S1(=O)CC(Cc2cc(OC(COC)C(F)(F)F)c(N)c(F)c2)C(O)C([NH3+])C1 displays no inhibition of the human beta-secretase 1 (BACE-1). | The chemical with the SMILES of S1(=O)CC(Cc2cc(OC(COC)C(F)(F)F)c(N)c(F)c2)C(O)C([NH3+])C1 displays no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
|
The chemical with the SMILES of s1c(ccc1C)-c1ccc(cc1)C1CC1C=1N=C(N)N(C)C(=O)C=1 exhibits no inhibition of the human beta-secretase 1 (BACE-1). | The chemical with the SMILES of s1c(ccc1C)-c1ccc(cc1)C1CC1C=1N=C(N)N(C)C(=O)C=1 exhibits no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
|
The compound with the SMILES of O=C1N(C)C(=NC(=C1)CCc1ccccc1)N shows no inhibition of the human beta-secretase 1 (BACE-1). | The compound with the SMILES of O=C1N(C)C(=NC(=C1)CCc1ccccc1)N shows no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
|
The chemical with the SMILES of Clc1cc2CC(N=C(NC(Cc3ccccc3)c3ocnn3)c2cc1)(C)C displays no inhibition of the human beta-secretase 1 (BACE-1). | The chemical with the SMILES of Clc1cc2CC(N=C(NC(Cc3ccccc3)c3ocnn3)c2cc1)(C)C displays no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
|
The compound with the SMILES of Clc1cc2nc(n(c2cc1)CCCC(=O)NC(C)C)N exhibits no inhibition of the human beta-secretase 1 (BACE-1). | The compound with the SMILES of Clc1cc2nc(n(c2cc1)CCCC(=O)NC(C)C)N exhibits no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
|
The chemical with the SMILES of Clc1cc2nc(n(c2cc1)CCCC(=O)N(Cc1cc(F)ccc1)C)N exhibits no inhibition of the human beta-secretase 1 (BACE-1). | The chemical with the SMILES of Clc1cc2nc(n(c2cc1)CCCC(=O)N(Cc1cc(F)ccc1)C)N exhibits no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
|
The compound with the SMILES of O=C1N(C)C(=NC(=C1)CCc1ccc(cc1)-c1ccccc1)N exhibits no inhibition of the human beta-secretase 1 (BACE-1). | The compound with the SMILES of O=C1N(C)C(=NC(=C1)CCc1ccc(cc1)-c1ccccc1)N exhibits no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
|
The chemical with the SMILES of O1C2COCCC2(N=C1N)c1cc(NC(=O)c2ncccc2)ccc1 exhibits no inhibition of the human beta-secretase 1 (BACE-1). | The chemical with the SMILES of O1C2COCCC2(N=C1N)c1cc(NC(=O)c2ncccc2)ccc1 exhibits no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
|
The chemical with the SMILES of Brc1cc(ccc1)C12N=C(OC1CCCC2)N displays no inhibition of the human beta-secretase 1 (BACE-1). | The chemical with the SMILES of Brc1cc(ccc1)C12N=C(OC1CCCC2)N displays no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
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The compound with the SMILES of O1C2CCCCC2(N=C1N)c1cc(NC(=O)c2ncccc2)ccc1 displays no inhibition of the human beta-secretase 1 (BACE-1). | The compound with the SMILES of O1C2CCCCC2(N=C1N)c1cc(NC(=O)c2ncccc2)ccc1 displays no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
|
The compound with the SMILES of O=C1N(C)C(=N[C@](C1)(CCc1ccccc1)C)N exhibits no inhibition of the human beta-secretase 1 (BACE-1). | The compound with the SMILES of O=C1N(C)C(=N[C@](C1)(CCc1ccccc1)C)N exhibits no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
|
The compound with the SMILES of Clc1cc2nc(n(c2cc1)C(CC(C)C)CC(=O)NCc1ncccc1)N shows no inhibition of the human beta-secretase 1 (BACE-1). | The compound with the SMILES of Clc1cc2nc(n(c2cc1)C(CC(C)C)CC(=O)NCc1ncccc1)N shows no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
|
The chemical with the SMILES of Clc1cc2nc(n(c2cc1)C(CC(=O)NCC1CC1)CC)N shows no inhibition of the human beta-secretase 1 (BACE-1). | The chemical with the SMILES of Clc1cc2nc(n(c2cc1)C(CC(=O)NCC1CC1)CC)N shows no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
|
The compound with the SMILES of Clc1cc2nc(n(c2cc1)C(CC(C)C)CC(=O)NC(C)C)N displays no inhibition of the human beta-secretase 1 (BACE-1). | The compound with the SMILES of Clc1cc2nc(n(c2cc1)C(CC(C)C)CC(=O)NC(C)C)N displays no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
|
The compound with the SMILES of Clc1cc2nc(n(c2cc1)CCCC(=O)NCc1cc(F)ccc1)N displays no inhibition of the human beta-secretase 1 (BACE-1). | The compound with the SMILES of Clc1cc2nc(n(c2cc1)CCCC(=O)NCc1cc(F)ccc1)N displays no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
|
The chemical with the SMILES of Clc1cc2CC(N=C(NC(Cc3ccccc3)c3nc(ccn3)C)c2cc1)(C)C shows no inhibition of the human beta-secretase 1 (BACE-1). | The chemical with the SMILES of Clc1cc2CC(N=C(NC(Cc3ccccc3)c3nc(ccn3)C)c2cc1)(C)C shows no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
|
The chemical with the SMILES of Clc1cc2nc(n(c2cc1)C(CC(=O)NCCC1CC[NH2+]C1)CC)N shows no inhibition of the human beta-secretase 1 (BACE-1). | The chemical with the SMILES of Clc1cc2nc(n(c2cc1)C(CC(=O)NCCC1CC[NH2+]C1)CC)N shows no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
|
The chemical with the SMILES of Clc1cc2nc(n(c2cc1)CCCC(=O)NC1CC[NH+](CC1)C)N exhibits no inhibition of the human beta-secretase 1 (BACE-1). | The chemical with the SMILES of Clc1cc2nc(n(c2cc1)CCCC(=O)NC1CC[NH+](CC1)C)N exhibits no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
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The compound with the SMILES of Clc1cc2CC(N=C(NC(Cc3ccccc3)c3oc(nn3)C)c2cc1)(C)C shows no inhibition of the human beta-secretase 1 (BACE-1). | The compound with the SMILES of Clc1cc2CC(N=C(NC(Cc3ccccc3)c3oc(nn3)C)c2cc1)(C)C shows no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
|
The chemical with the SMILES of Clc1cc2nc(n(c2cc1)CCCC(=O)NCc1ncccc1)N exhibits no inhibition of the human beta-secretase 1 (BACE-1). | The chemical with the SMILES of Clc1cc2nc(n(c2cc1)CCCC(=O)NCc1ncccc1)N exhibits no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
|
The compound with the SMILES of Clc1cc2nc(n(c2cc1)C(CC(=O)NCC[NH+]1CCOCC1)CC)N exhibits no inhibition of the human beta-secretase 1 (BACE-1). | The compound with the SMILES of Clc1cc2nc(n(c2cc1)C(CC(=O)NCC[NH+]1CCOCC1)CC)N exhibits no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
|
The compound with the SMILES of Clc1cc2nc(n(c2cc1)C(CC(=O)NC(C)C)CC)N shows no inhibition of the human beta-secretase 1 (BACE-1). | The compound with the SMILES of Clc1cc2nc(n(c2cc1)C(CC(=O)NC(C)C)CC)N shows no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
|
The compound with the SMILES of Clc1cc2nc([nH]c2cc1)N shows no inhibition of the human beta-secretase 1 (BACE-1). | The compound with the SMILES of Clc1cc2nc([nH]c2cc1)N shows no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
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The compound with the SMILES of Clc1cc2nc(n(c2cc1)CCCC(=O)NCC[NH+]1CCOCC1)N exhibits no inhibition of the human beta-secretase 1 (BACE-1). | The compound with the SMILES of Clc1cc2nc(n(c2cc1)CCCC(=O)NCC[NH+]1CCOCC1)N exhibits no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
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The compound with the SMILES of Clc1cc2nc(n(c2cc1)C(CC(=O)NCc1ncccc1)CC)N shows no inhibition of the human beta-secretase 1 (BACE-1). | The compound with the SMILES of Clc1cc2nc(n(c2cc1)C(CC(=O)NCc1ncccc1)CC)N shows no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
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The compound with the SMILES of Brc1cc(ccc1)C1CC1C=1N=C(N)N(C)C(=O)C=1 shows no inhibition of the human beta-secretase 1 (BACE-1). | The compound with the SMILES of Brc1cc(ccc1)C1CC1C=1N=C(N)N(C)C(=O)C=1 shows no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
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The compound with the SMILES of O=C1N(C)C(=NC(=C1)C1CC1c1cc(ccc1)-c1ccccc1)N exhibits no inhibition of the human beta-secretase 1 (BACE-1). | The compound with the SMILES of O=C1N(C)C(=NC(=C1)C1CC1c1cc(ccc1)-c1ccccc1)N exhibits no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
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The chemical with the SMILES of Clc1cc2nc(n(c2cc1)CCCC(=O)NCC1CC1)N exhibits no inhibition of the human beta-secretase 1 (BACE-1). | The chemical with the SMILES of Clc1cc2nc(n(c2cc1)CCCC(=O)NCC1CC1)N exhibits no inhibition of the human beta-secretase 1 (BACE-1). | [] | null |
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