smiles stringlengths 4 254 |
|---|
Cc1nonc1CC(=O)NCCCN1CCN(CC#N)CC1 |
C[C@@H](CNC(=O)c1c[nH]nc1C1CC1)NCC(=O)NCC#N |
COCC#CCN(CCNC(=O)c1c[nH]c(=O)cn1)C1CC1 |
CNC(=O)c1cccc(C(=O)N(C)CCNCC#CCOC)n1 |
COCC#CCN1[C@H]2CC[C@H]1CN(C(=O)CCn1cncn1)C2 |
C#CCNC(=O)[C@@H](C)N1CC(NC(=O)c2cccc(C)n2)C1 |
COc1coc(CNC[C@@H](O)CNC(=O)C#CC2CC2)cc1=O |
C=CCC[C@H](C)N1CC(O)(CNC(=O)C2CS(=O)(=O)C2)C1 |
C#CCN1CCC[C@@](CO)(NC(=O)c2ccc3nncn3c2)C1 |
C#CCNC(=O)CN1CCOC[C@@H]1CNC(=O)[C@@H]1CC1(C)C |
Cc1cnc(C(=O)N2C[C@@H](C)[C@@H](NCC(=O)NCC#N)C2)cn1 |
CN(C)CCCC(=O)N1CCC(C)(NCC(=O)NCC#N)CC1 |
COCC#CCN[C@H](C)CN(C)C(=O)c1ccc2nnnn2c1 |
C#CCNC(=O)[C@@H](C)N[C@H](C)CN(C)C(=O)Cc1[nH]cnc1C |
C#Cc1ccc(C(=O)N(C)C[C@@H](O)CN(C)C[C@H](C)O)cn1 |
C#CCCCCC(=O)N(C)C[C@@H](O)CNC(=O)c1cn(C)nn1 |
C=CCO[C@@H](C)C(=O)NC[C@H](O)CN(C)C(=O)C#CC1CC1 |
C=CCCOCC(=O)N1C[C@H](O)[C@H](NC(=O)[C@H](C)COC)C1 |
C#CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CC)NC(C)=O)CCO2 |
C=CC[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](N)CN)C2 |
N#CC1(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C(O)O)C3)CCC1 |
N#CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C1CC1)CCO2 |
CC[C@H](C)[C@H](O)C(=O)N1CCCC12CN(C(=O)C#CC(=O)O)C2 |
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