Compound List
| Compound | Smiles | Mol |
|---|---|---|
|
C1
|
CCC(=O)NCc1nnc2n1CCCC2 |
|
|
C2
|
CNS(=O)(=O)c1ccccc1Cl |
|
|
C4
|
Cc1cn[nH]c1-c1ccncc1 |
|
|
C7
|
CC(=O)Nc1ccc(-c2csc(N)n2)cc1 |
|
|
C8
|
CS(=O)(=O)NC1CCCC1 |
|
|
C9
|
CCS(=O)(=O)NCc1ccc2c(c1)OCO2 |
|
|
C10
|
O=C(c1c(F)cccc1F)N1CCCCCC1 |
|
|
C11
|
c1cncc(Cn2cccc2)c1 |
|
|
C12
|
O=S(=O)(c1ccc(F)cc1)N1CCNCC1 |
|
|
C14
|
CC(C)(CO)NC(=O)c1cccc(Cl)c1 |
|
|
C15
|
CC(=O)Nc1ccc(Nc2ccccc2)cc1 |
|
|
C16
|
CCn1c(NC(C)=O)nc2ccccc21 |
|
|
C17
|
Cc1nn(C)c(C)c1NS(=O)(=O)c1cccc(F)c1 |
|
|
C18
|
Cc1ccc(NC(=O)C2CCCO2)nc1 |
|
|
C19
|
O=S1(=O)CCCN1Cc1cccc(F)c1 |
|
|
C20
|
Cc1nc(C)c(C(C)NC(=O)C(C)C)s1 |
|
|
C21
|
Fc1ccc(NC2CCOCC2)nc1 |
|
|
C22
|
CNS(=O)(=O)CC1CCCCC1 |
|
|
C23
|
CNC(=O)c1cnc(C)s1 |
|
|
C24
|
Clc1cccc2nc[nH]c12 |
|
|
C25
|
CC(C)N1CCN(C(=O)c2cccs2)CC1 |
|
|
C26
|
N#CCc1nccn1CC(F)(F)F |
|
|
C27
|
Cc1cc(Cn2nc(C)ccc2=O)on1 |
|
|
C29
|
COc1ccccc1-c1nnco1 |
|
|
C31
|
Fc1cn[nH]c1 |
|
|
C32
|
CC(=O)NCC1(O)CCCC1 |
|
|
C33
|
c1ncc2c(n1)CC1CCC2N1 |
|
|
C34
|
Nc1cccnc1-n1cccc1 |
|
|
C36
|
O=S1(=O)CCN(Cc2ccco2)CC1 |
|
|
C37
|
COC1CN(S(=O)(=O)N2CCCC2)C1 |
|
|
C38
|
Cc1cccc(OC2CCN(C)C2=O)c1F |
|
|
C39
|
CNS(=O)(=O)c1cccc(C)c1F |
|
|
C40
|
Cn1ccnc1-c1noc(C2CCC2)n1 |
|
|
C41
|
CN(CC1CCOC1)c1ncncc1Cl |
|
|
C42
|
NC(=O)N1CCN(c2ccc(F)cc2)CC1 |
|
|
C43
|
Cc1ncc(CNc2cncc(F)c2)s1 |
|
|
C45
|
COc1ccc(C(=O)C2CCNCC2)cc1 |
|
|
C46
|
N#Cc1ccc(Cn2cnc3ccccc32)cc1 |
|
|
C47
|
NC(=S)Nc1ccccc1OC(F)(F)F |
|
|
C48
|
CN(Cc1cccc(F)c1)S(N)(=O)=O |
|
|
C49
|
O=C(c1ccc2c(c1)OCO2)N1CCCCCC1 |
|
|
C50
|
O=C(CCC1CCCCC1)N1CCOCC1 |
|
|
C51
|
O=C(c1ccco1)N1CCN(C(=O)C2CC2)CC1 |
|
|
C52
|
CC1CCN(C(=O)c2cc3ccccc3o2)CC1 |
|
|
C53
|
CC1=NN(c2cccc(N)c2)C(=O)C1 |
|
|
C54
|
NS(=O)(=O)c1cnc2cccnn12 |
|
|
C57
|
CC(=O)NCc1cn[nH]c1 |
|
|
C58
|
CC(N)c1ccc(NC(=O)C2CC2)cc1 |
|
|
C59
|
CC1CCCC(CO)N1S(C)(=O)=O |
|
|
C61
|
CC1C(C(=O)N2CCCC2)CCCN1S(C)(=O)=O |
|
|
C62
|
Ic1cn[nH]c1 |
|
|
C63
|
O=S1(=O)CC(O)C1 |
|
|
C66
|
O=c1cccn[nH]1 |
|
|
C67
|
Nc1ccon1 |
|
|
C68
|
Brc1ncccn1 |
|
|
C69
|
NC(c1ccccc1)c1ccccc1 |
|
|
C70
|
O=C1CCN(c2ccccn2)CC1 |
|
|
C71
|
O=C1NC2(CCCC2)Nc2ccccc21 |
|
|
C72
|
Cc1ccc(CCNc2ccccc2)cn1 |
|
|
C73
|
CCn1cnc2ccccc21 |
|
|
C74
|
CNC(=O)c1cn(C)c2ccccc12 |
|
|
C76
|
OCCN1CCOCC1 |
|
|
C77
|
CC(=O)NCc1ncc[nH]1 |
|
|
C78
|
COc1cccc2[nH]ccc12 |
|
|
C80
|
CNc1nccc2ccccc12 |
|
|
C82
|
O=c1ccc(OC(F)F)c[nH]1 |
|
|
C83
|
CC(=O)Nc1cccc2cc[nH]c12 |
|
|
C87
|
CN1CCCc2ccc(S(N)(=O)=O)cc21 |
|
|
C88
|
CC(N)c1nc(Cc2ccccc2)no1 |
|
|
C90
|
COc1ccc(NC(=O)CN)cc1 |
|
|
C92
|
Cc1ccc(F)c(C(=O)N2CCNC(C)C2)c1 |
|
|
C93
|
CN(C(=O)C1CCNC1)c1ccccc1 |
|
|
C94
|
CS(=O)(=O)NC1CCNCC1 |
|
|
C95
|
CNC(=O)C1CCCc2sc(C)nc21 |
|
|
C96
|
CC(CO)N(C)c1ncc(Cl)cn1 |
|
|
C97
|
CC(O)CNC(=O)Nc1ccccc1 |
|
|
C99
|
Fc1ccc(-c2cc[nH]n2)nc1 |
|
|
C100
|
Cc1cccc(O)c1NC(=O)c1ccncc1F |
|
|
C101
|
CC(O)CNCc1ccc2c(c1)OCO2 |
|
|
C104
|
CC(=O)Nc1cccc(NC(N)=O)c1 |
|
|
C105
|
CC1CN(C(=O)Cn2cccn2)CCO1 |
|
|
C106
|
Cc1nc(-c2cccc(N)c2)no1 |
|
|
C108
|
COc1ccc(C)cc1NC(=O)CN |
|
|
C109
|
CNCc1cnn(-c2ccccc2)c1 |
|
|
C110
|
CC(=O)c1cccc(NC(=O)N2CCOCC2)c1 |
|
|
C111
|
CC(=O)N1CCN(c2ccc(Cl)cc2)CC1 |
|
|
C112
|
CC(=O)NC1CNc2ccccc2C1 |
|
|
C114
|
Cc1nccn1Cc1cccc(C#N)c1 |
|
|
C115
|
CCC(=O)Nc1nc(C)cs1 |
|
|
C116
|
Cc1ccc(F)cc1NC(=O)c1ccncc1 |
|
|
C117
|
O=C1CN(C(=O)COc2ccccc2)CCN1 |
|
|
C118
|
COc1ccc(NC(=O)Nc2ccncc2)cc1 |
|
|
C120
|
Fc1cccc(C2CCCCN2)c1 |
|
|
C122
|
Fc1ccccc1CNC1CCOCC1 |
|
|
C124
|
O=C(c1cn[nH]c1)N1CCOCC1 |
|
|
C125
|
Cc1cc(Br)ccc1C(=O)NCC(C)O |
|
|
C126
|
Fc1ccccc1NCc1cc[nH]n1 |
|
|
C129
|
CN1CCN(C(=O)Nc2ccc(F)cc2)CC1 |
|
|
C130
|
O=C(Nc1ccccc1)Nc1cccnc1 |
|
|
C132
|
Cc1ccc(-c2nc(N)sc2C)cc1C |
|
|
C134
|
CC1=NN(c2ccccc2)C(=O)C1 |
|
|
C135
|
Cc1ccccc1CC(N)=O |
|
|
C137
|
COc1ccc(CCC2(C)NC(=O)NC2=O)cc1 |
|
|
C138
|
CCN(CC)c1cc(C)nc2ncnn12 |
|
|
C139
|
CN(C)C(=O)Cn1cnc(N)n1 |
|
|
C140
|
CC(=O)N1CCOc2ccccc2C1 |
|
|
C142
|
CN(C)C(=O)COc1ccc(N)c(F)c1 |
|
|
C143
|
Cc1cc(F)ccc1CS(N)(=O)=O |
|
|
C147
|
CCOC(=O)c1cn[nH]c1 |
|
|
C148
|
Cc1cccc(NCC2CCNC2)n1 |
|
|
C149
|
COC(=O)C1(c2ccc(F)cc2)CCCNC1 |
|
|
C150
|
Cn1cc(C2CCCC2CO)cn1 |
|
|
C151
|
CC(=O)N1C2CCC1c1cccnc1C2 |
|
|
C152
|
CC1(C(N)=O)CCCN1S(C)(=O)=O |
|
|
C153
|
COC(=O)C1(Cc2ccc(F)cc2)CCNC1 |
|
|
C154
|
COC(=O)C1(c2ccc(C)cc2)CCNC1 |
|
|
C155
|
OCC1CNCC1c1ccccc1F |
|
|
C158
|
CS(=O)(=O)c1ccc(Br)cc1 |
|
|
C160
|
OCCn1cc(Br)cn1 |
|
|
C161
|
O=C1CCC(=O)N1 |
|
|
C162
|
OCC1CC1 |
|
|
C163
|
NC1CCCC1 |
|
|
C164
|
CCC(=O)NO |
|
|
C166
|
N#Cc1c[nH]cn1 |
|
|
C170
|
Cc1cc2ccccc2nc1N |
|
|
C172
|
CCc1ccc(NC2=NCCCS2)cc1 |
|
|
C177
|
O=C(c1ccccc1F)N1CCNCC1 |
|
|
C178
|
CC1C(=O)NC(=O)N1c1ccc(Cl)cc1 |
|
|
C181
|
O=C1NC(=O)C2(CCc3ccccc32)N1 |
|
|
C185
|
CC(=O)c1ccc2c(c1)CCCN2 |
|
|
C186
|
O=C(NC1CC1)c1ccccc1O |
|
|
C188
|
Cn1c(N)nc2ccccc21 |
|
|
C190
|
CC1(C)OC(=O)c2cc(Br)c(O)cc2O1 |
|
|
C193
|
Cn1nc(C(F)(F)F)cc1O |
|
|
C195
|
Cc1cc(-c2ccccc2)n[nH]1 |
|
|
C196
|
Oc1cnc(-c2ccccc2)nc1 |
|
|
C197
|
CNC(=O)c1cccc2cc[nH]c12 |
|
|
C198
|
CS(=O)(=O)NC1CCOc2ccccc21 |
|
|
C200
|
NC(=O)c1ccnc(NC2CC=CC2)c1 |
|
|
C202
|
CC(N)c1cn(-c2ccccc2)nn1 |
|
|
C203
|
Cn1nc(C(N)=O)c2ccccc21 |
|
|
C204
|
CCC(=O)Nc1cccc(N)c1C |
|
|
C205
|
O=C(NCCN1CCCC1=O)Nc1ccccc1 |
|
|
C206
|
Cc1nn(C)c(C)c1CC(N)=O |
|
|
C207
|
CNc1ccc2ccccc2n1 |
|
|
C209
|
COc1ccccc1NC(N)=S |
|
|
C210
|
CC1(C)NCCC1c1ccc(F)cc1 |
|
|
C211
|
COc1cccc(S(=O)(=O)NC(=O)c2cc(-c3ccc(C#CCO)s3)c(OC)cc2OC)c1 |
|
|
C212
|
COC1CC(OC)C(c2cccs2)CC1C(=O)O |
|
|
C213
|
O=C(O)Cc1ccc(O)c(-c2ccccc2)c1 |
|
|
C214
|
COc1ccc(CC(=O)O)cc1-c1ccsc1 |
|
|
C215
|
COc1ccc(CC(=O)O)cc1-c1cccs1 |
|
|
C216
|
O=C(O)Cc1cc(CC(=O)O)cc(-c2ccc(C#CCO)s2)c1 |
|
|
C217
|
Cc1oc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)cc2c1C(=O)O |
|
|
C219
|
CC(=O)Oc1ccc2oc(=O)sc2c1 |
|
|
C221
|
COc1cc(C)c(C(=O)NS(=O)(=O)c2cccc3cccnc23)cc1-c1ccc(C#CCO)s1 |
|
|
C222
|
O=C(NC(Cc1ccc(O)cc1)C(=O)O)c1cc(-c2ccccc2)c(=O)n2c1sc1ccc(OC3CCCCC3)cc12 |
|
|
C223
|
O=C(O)Cc1cc(CC(=O)O)cc(-c2cccs2)c1 |
|
|
C226
|
O=C(Cc1ccccc1Nc1c(Cl)cccc1Cl)NC1(C(=O)O)Cc2ccccc2C1 |
|
|
C227
|
COc1cc(C)c(C(=O)NS(C)(=O)=O)cc1-c1ccc(C#CCO)s1 |
|
|
C229
|
O=C(O)Cc1cc(CC(=O)O)cc(-c2ccccc2)c1 |
|
|
C233
|
CCCCN(Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1)C(=O)N1CCN(C(=O)C(C)(c2ccccc2)c2ccccc2)C(C(=O)O)C1 |
|
|
C234
|
COc1ccc(CC(=O)O)cc1-c1ccccc1 |
|
|
C264
|
Cc1ccc(NC(=O)c2ccncc2)c2cccnc12 |
|
|
C267
|
O=C(Nc1ccc(Cl)c2ncccc12)c1ccncc1 |
|
|
C329
|
CCS(=O)(=O)NCC1CC(=O)N(c2ccc(Cl)cc2)C1 |
|
|
C331
|
CC(C)(CO)NC(=O)c1csc(-c2ccsc2)n1 |
|
|
C332
|
CC(O)CNC(=O)Nc1cccc2cccnc12 |
|
|
C333
|
CCS(=O)(=O)NCc1nc2cc(Cl)ccc2[nH]1 |
|
|
C334
|
c1nc(CCNC2=NCCCS2)no1 |
|
|
C336
|
c1ncn(CCNC2=NCCCS2)n1 |
|
|
C337
|
c1noc(CCNC2=NCCCS2)n1 |
|
|
C338
|
CC1CCSC(NCCc2ncon2)=N1 |
|
|
C340
|
CC1CN=C(NCCc2ncon2)SC1 |
|
|
C341
|
CC1CN=C(NCCc2ncno2)SC1 |
|
|
C342
|
CC(CNC1=NCCCS1)c1ncon1 |
|
|
C343
|
c1cc2cc(N3CCCCCC3)ccc2[nH]1 |
|
|
C345
|
c1cc2cc(C3=NCCS3)ccc2[nH]1 |
|
|
C346
|
c1cc2cc(N3CCCCC3)ccc2[nH]1 |
|
|
C348
|
O=C(CCCn1ccc2cc(Cl)ccc21)OC1CCSC1 |
|
|
C350
|
C=C1CCN(c2ncccn2)C1 |
|
|
C351
|
c1ncc(N2CCCC2)cn1 |
|
|
C352
|
c1cc(N2CCCC2)ncn1 |
|
|
C353
|
CC1CCSC(NC(C)c2ccncc2)=N1 |
|
|
C394
|
CC(C)n1cc(NC2=NCCCS2)cn1 |
|
|
C395
|
CC(Cn1cccn1)NC1=NCCCS1 |
|
|
C396
|
CN(CCNC(=O)Cc1ccns1)C(=O)c1cncc(O)c1 |
|
|
C398
|
c1cncc(-c2ncco2)c1 |
|
|
C399
|
c1ccc(-n2cccn2)nc1 |
|
|
C400
|
c1ccc(-c2nccs2)nc1 |
|
|
C401
|
c1ccc(-c2ncco2)nc1 |
|
|
C402
|
O=C(NCCc1cn[nH]c1)OC1CCOC1 |
|
|
C404
|
O=C(O)C1(CNCc2cc[nH]n2)CCOC1 |
|
|
C406
|
CC(NCCc1cn[nH]c1)C1CCCO1 |
|
|
C408
|
CC(NC(C)C1CCCO1)c1cn[nH]c1 |
|
|
C410
|
O=C(CCCC1CCOC1)c1cn[nH]c1 |
|
|
C411
|
CCC1OCCC1CNCc1cn[nH]c1 |
|
|
C412
|
c1cc(C2CCCO2)no1 |
|
|
C414
|
CCC1OCCC1CNCc1cc[nH]n1 |
|
|
C416
|
CCC1CC(NCCc2ccn[nH]2)CO1 |
|
|
C417
|
[O-][S+](CCC1CNC1)C1CCOC1 |
|
|
C418
|
c1cc(C23CCCCC2C3)[nH]n1 |
|
|
C419
|
C1=CC(n2cccn2)CCC1 |
|
|
C421
|
CC(C(=O)NCc1ccon1)C1CCOC1 |
|
|
C422
|
O=C(NOC1CCOC1)N1CCN(c2cccnc2)C(=O)C1 |
|
|
C424
|
CC1OCCC1[S+]([O-])CCC1CNC1 |
|
|
C426
|
c1ccc(N2CCNC3CC32)nc1 |
|
|
C427
|
CC(CC(=O)N1CCOC(c2cc[nH]n2)C1)C1CCNCC1 |
|
|
C428
|
c1cc(NCCCNCc2ncc[nH]2)ccn1 |
|
|
C429
|
c1ccc(C(NCCCNc2ccncc2)c2ncc[nH]2)cc1 |
|
|
C430
|
O=C1CC(CC(=O)N2CCCC(c3ccn[nH]3)C2)CC(=O)N1 |
|
|
C432
|
O=C1CCC(CN2CCCC(c3ccn[nH]3)C2)C(=O)N1 |
|
|
C434
|
CC(C)n1ccnc1CNCCCNc1ccncc1 |
|
|
C436
|
CN(CC(O)CN(C)C(=O)C1(F)CCOC1)C(=O)c1cnc[nH]1 |
|
|
C437
|
CC(C)(C)n1ccnc1CNCCCNc1ccccc1 |
|
|
C438
|
CC(C)c1c[nH]c(CNCCCNc2ccccc2)n1 |
|
|
C439
|
c1ccc(NCCCNCc2nccn2C2CC2)cc1 |
|
|
C440
|
CN(Cc1cncs1)C(=O)c1c[nH]c(C(=O)O)c1 |
|
|
C442
|
CCc1ccnc(C(=O)N(C)CCCN(C)C(=O)c2cnc[nH]2)c1 |
|
|
C443
|
CN(Cc1cc[nH]n1)C(=O)Cc1scnc1-c1ccccc1 |
|
|
C444
|
CCn1cncc1CN(C)C(=O)C1C=CCN1 |
|
|
C445
|
O=S(=O)(c1cc[nH]n1)N1CCCC1CCl |
|
|
C447
|
CC(NS(=O)(=O)c1c[nH]c(C(=O)O)c1)c1cccnc1 |
|
|
C448
|
CCN(C(=O)c1c[nH]c(C(=O)O)c1)C(C)c1cccnc1 |
|
|
C449
|
CN(Cc1cncn1C)C(=O)C1CCN1 |
|
|
C450
|
Cc1cnc(CNC(C)c2ncc[nH]2)[nH]1 |
|
|
C451
|
CC(C)(CCNCc1ccc[nH]1)N1CCNCC1 |
|
|
C452
|
c1cc(N2CCCOCC2)ccn1 |
|
|
C454
|
CC(CO)(CC1COC1)c1ccncc1 |
|
|
C455
|
CN(CCNC(=O)CC1CCCCO1)C(=O)c1cccnc1 |
|
|
C461
|
O=C(C=Cc1cscn1)OCCCCC1CCCO1 |
|
|
C463
|
O=C1CCC(C(=O)N(CC2CCCO2)c2ccncc2)CC1 |
|
|
C464
|
COc1ccncc1C(=O)N(C)CCNC(=O)Cc1ccno1 |
|
|
C465
|
Cc1ncsc1CC(=O)N(C)Cc1ccns1 |
|
|
C466
|
O=C(O)c1cc(S(=O)(=O)NCc2ccncc2)c[nH]1 |
|
|
C468
|
O=C(O)c1cc(S(=O)(=O)N(CCCO)Cc2ccccn2)c[nH]1 |
|
|
C470
|
O=C(O)c1cc(S(=O)(=O)Nc2cnoc2)c[nH]1 |
|
|
C473
|
CC(O)c1ncc(CNC(CCc2ccccc2)CC(=O)O)s1 |
|
|
C475
|
S=c1[nH]nc(-c2ncc[nH]2)s1 |
|
|
C476
|
CCc1ncc(CNC(CCc2ccccc2)CC(=O)O)s1 |
|
|
C478
|
c1nc(-c2n[nH]c3c2CCCC3)c[nH]1 |
|
|
C479
|
Cc1ncc(COC(=O)COc2ccsc2)s1 |
|
|
C481
|
Cc1ncsc1COC(=O)COc1ccsc1 |
|
|
C483
|
CN(C)C(=O)Cc1ccc[nH]1 |
|
|
C485
|
O=C(CCCC1CCOC1)c1ncc[nH]1 |
|
|
C486
|
CC(=O)NCCN(Cc1ccsc1)C(=O)c1ccc(O)nc1 |
|
|
C488
|
c1ccc(-c2cccnc2)cc1 |
|
|
C490
|
c1c[nH]c(SCCSC2CCOC2)n1 |
|
|
C491
|
CC(=O)NCCN(Cc1ccsc1)C(=O)c1cnccc1O |
|
|
C493
|
CC(=O)NCCN(Cc1ccccc1)C(=O)c1cccnc1O |
|
|
C494
|
CCOC(=O)c1nc(CC)sc1-c1ccn[nH]1 |
|
|
C495
|
CC(Cc1ccncc1)(C(=O)O)n1cc(-c2ccncc2)cn1 |
|
|
C497
|
S=c1cc(-c2ccccn2)cn[nH]1 |
|
|
C498
|
CCOC(=O)CC(C)OC(=O)c1ccnn1-c1ccncc1 |
|
|
C500
|
c1cc(-c2cnc[nH]2)ccn1 |
|
|
C501
|
CC(O)CCNC(=O)Nc1ncc(CC2CCCOC2)s1 |
|
|
C503
|
CCCCN(CCCC)C(=O)Nc1ncc(CC2CCOC2)s1 |
|
|
C505
|
CC(CNC(=O)Nc1ncc(CC2CCOCC2)s1)S(N)(=O)=O |
|
|
C506
|
O=C(NCCc1cncs1)OC1COC1 |
|
|
C507
|
c1ccc(N2CCCOCC2)nc1 |
|
|
C508
|
c1cnn(C2CCOCC2)c1 |
|
|
C510
|
CC(CC1CCCCO1)(C(=O)O)n1ccc(C(F)(F)F)n1 |
|
|
C512
|
CSCC(C)CNC(C)c1cn(C)nc1C1CCOCC1 |
|
|
C514
|
Cc1nc(C(C)OC(=O)CNC(=O)Nc2ccccc2)cs1 |
|
|
C515
|
Cc1nc(-c2ccccn2)sc1C(=O)NC(C)C(C)C(=O)O |
|
|
C664
|
O=C(Nc1nc(-c2cnco2)cs1)C1CCCO1 |
|
|
C665
|
CC1CCN(CC(=O)NCC=Cc2cccnc2)CC1 |
|
|
C666
|
CC(CC(=O)Nc1c[nH]nc1-c1nccs1)n1cccc1 |
|
|
C667
|
O=C(CCCc1nccs1)Nc1c[nH]nc1-c1ccccc1 |
|
|
C668
|
c1cc(-c2ccc(CNCCc3cscn3)o2)[nH]n1 |
|
|
C669
|
Brc1cccnc1N1CCC12CC(c1ncc[nH]1)C2 |
|
|
C670
|
O=C(NCCc1nccs1)NCc1cc(-c2ccccc2)[nH]n1 |
|
|
C671
|
O=C(Cc1ncc[nH]1)Nc1cccc(C2CC2)n1 |
|
|
C672
|
CCCn1ccnc1C(=O)c1ccn[nH]1 |
|
|
C673
|
CC(C)(NC(=O)C=Cc1cn[nH]c1)c1nc(C(F)(F)F)cs1 |
|
|
C674
|
Cc1csc(C(C)(C)NC(=O)C=Cc2cn[nH]c2)n1 |
|
|
C675
|
O=C(NCCc1ccccn1)c1cccn1C1CCNCC1 |
|
|
C676
|
Cn1nc(-c2ccccn2)nc1-c1ncc[nH]1 |
|
|
C677
|
O=C(NCc1ccccn1)c1cccn1C1CCNCC1 |
|
|
C678
|
O=C(OCCc1cn[nH]c1)c1csc(Cl)n1 |
|
|
C679
|
Cc1ccc(CCOC(=O)CC(C)n2cccc2)cn1 |
|
|
C680
|
CC(C)C(=O)NC(C)c1ccc(F)cn1 |
|
|
C681
|
CC(Oc1cccnc1)C(=O)NCC(CO)c1cccnc1 |
|
|
C682
|
CCC(CNC(=O)Cn1ccnc1C)NCc1cscn1 |
|
|
C683
|
CCN(C(C)c1cccnc1)S(=O)(=O)Cc1cccnc1 |
|
|
C685
|
COc1cc(NCc2cncs2)ccn1 |
|
|
C686
|
CCn1cnc(C(O)C2CCCCN2)c1 |
|
|
C687
|
CC(NC(=O)NCc1ccnc(C2CC2)c1)c1cscn1 |
|
|
C688
|
Cn1cncc1-c1nnc(C2CCCCN2)o1 |
|
|
C689
|
Cc1nccn1CCCCNC(=O)C(=O)NCCC1CCCCN1 |
|
|
C690
|
CCC(C)n1nc(-c2ccncc2)nc1-c1ncc[nH]1 |
|
|
C692
|
CCCCCSCCn1ccnc1C(=O)c1ccncc1 |
|
|
C693
|
CC(CNC(=O)c1ccc(-c2nc[nH]n2)nc1)c1ncc[nH]1 |
|
|
C694
|
N#Cc1cc(-c2nc(-c3ncc[nH]3)no2)c[nH]1 |
|
|
C695
|
O=C(NCc1ncc[nH]1)c1ccnc(-n2cccc2)c1 |
|
|
C696
|
CC(NC(=O)c1ccnc(-n2cccc2)c1)c1ncc[nH]1 |
|
|
C697
|
c1ccn(-c2cc(-c3nc(-c4ncc[nH]4)no3)ccn2)c1 |
|
|
C698
|
c1ccc(-c2nnc(-c3ccc(-n4ccnc4)nn3)o2)nc1 |
|
|
C699
|
COC(=O)Cc1ncc(-c2cccnc2)[nH]1 |
|
|
C700
|
NCCCCc1ncc(-c2cccnc2)[nH]1 |
|
|
C702
|
OC1(CNCc2ccn[nH]2)CCOC1 |
|
|
C704
|
CC1(CNCc2ccn[nH]2)CCOC1 |
|
|
C706
|
OC1COCC1CNCc1ccn[nH]1 |
|
|
C708
|
O=C(CCCn1cccc1)NCc1ccc(-n2ccnc2)nc1 |
|
|
C709
|
CCn1cnc(-n2cccc2)c1 |
|
|
C710
|
O=C(NCc1ccn[nH]1)C1CCOC1 |
|
|
C711
|
CC(C)(CNS(=O)(=O)c1ccn[nH]1)C1(O)CCOC1 |
|
|
C718
|
O=C(CSCc1ncc[nH]1)NCCCCCN1CCCC1 |
|
|
C719
|
C=C(Cn1ccnc1)C(=O)NC(CO)Cc1cccnc1 |
|
|
C722
|
CC(OCC1CCCO1)C(=O)OCc1[nH]cnc1C(F)(F)F |
|
|
C723
|
c1cncc(-c2nnc(-c3ccnc(-n4ccnc4)c3)o2)c1 |
|
|
C724
|
O=C(CCCn1ccnc1)NC(CO)C(O)c1cccnc1 |
|
|
C725
|
CC(Cc1cnc[nH]1)C(=O)NCc1nnc(N2CCCC2)o1 |
|
|
C726
|
Cc1cncn1CC(=O)NC(CCNC(=O)c1cccnc1)C(C)C |
|
|
C727
|
O=C(Cc1cccnc1)NCC(O)CNCc1cscn1 |
|
|
C728
|
Cc1nc(CNCC(O)CNC(=O)Cc2cccnc2)cs1 |
|
|
C730
|
c1ccc2c(CN3CCCC(c4ccn[nH]4)C3)nccc2c1 |
|
|
C732
|
CCC(NC(=O)Nc1ccc(OC(F)F)cn1)C1CCCO1 |
|
|
C733
|
O=C(NC1CCC12CNC2)c1ccc(-c2ccncc2)nc1 |
|
|
C735
|
CC(CC(=O)Nc1cn[nH]c1C#N)C1CCCO1 |
|
|
C737
|
Cn1cc(C(=O)CNC(=O)C2CCCO2)cn1 |
|
|
C739
|
CC(C)(NCc1ccnn1C1CCCC1)C1CCCO1 |
|
|
C740
|
O=C(NCC1CCCO1)c1ccn(C2CCCC2)n1 |
|
|
C741
|
O=S(=O)(NCC1CCCO1)c1ccnn1C1CCCC1 |
|
|
C743
|
O=S(=O)(NCC1CCCO1)c1cnn(C2CCCC2)c1 |
|
|
C745
|
Clc1cc(NCc2ccn[nH]2)ccn1 |
|
|
C746
|
Fc1cnccc1NCc1ccn[nH]1 |
|
|
C747
|
C=CCNC(=O)c1ccc(N2CCC(c3ccn[nH]3)C2)nc1 |
|
|
C748
|
Clc1ccc(N2CCC(c3ccn[nH]3)C2)nc1 |
|
|
C749
|
CNS(=O)(=O)c1ccc(N2CCC(c3ccn[nH]3)C2)nc1 |
|
|
C750
|
CS(=N)(=O)c1ccc(N2CCC(c3ccn[nH]3)C2)nc1 |
|
|
C751
|
OCc1ccnc(N2CCC(c3ccn[nH]3)C2)c1 |
|
|
C752
|
CS(=O)(=O)c1ccc(N2CCC(c3ccn[nH]3)C2)nc1 |
|
|
C753
|
c1cc(C2CCN(c3ccc(C4CC4)cn3)C2)[nH]n1 |
|
|
C754
|
N#Cc1ccc(OCCNC(=O)CCc2nccs2)nc1 |
|
|
C755
|
[O-][S+](CCC1CCCNC1)C1CCOC1 |
|
|
C756
|
COC(=O)c1[nH]c(C(C)C)cc1-c1cn[nH]c1 |
|
|
C757
|
O=C(O)C1(CCc2ccccn2)CCOC1 |
|
|
C759
|
CC(=Cc1ccccn1)C(=O)N(C)C1(C(=O)O)CCOC1 |
|
|
C760
|
O=C(c1ccncc1)c1c[nH]c(C(=O)O)c1 |
|
|
C761
|
CC(NCc1nc(Br)c[nH]1)c1cncs1 |
|
|
C762
|
Cc1cnc(CNC(C)c2cncs2)[nH]1 |
|
|
C763
|
CCC1(CNc2ccccn2)CCCO1 |
|
|
C764
|
CC(CNC(=O)Cc1cncs1)CNC(=O)Cc1cncn1C |
|
|
C765
|
COCCN(Cc1cncs1)C(=O)Cn1cnc(C(=O)O)c1 |
|
|
C766
|
CC(c1noc(-c2ccccn2)n1)C1CCCO1 |
|
|
C767
|
CC(C)c1[nH]ccc1C(=O)NCCN(CCO)C(=O)c1ccncc1 |
|
|
C768
|
CC(F)(F)CCSCc1csc(-c2ccccn2)n1 |
|
|
C770
|
CCC1OCCC1NC(=O)NCc1ccccn1 |
|
|
C771
|
CCN(CCNC(=O)c1ccncc1)C(=O)c1cc[nH]c1C(C)C |
|
|
C772
|
O=C(NOc1ccccc1)c1csc(-c2ccccn2)n1 |
|
|
C773
|
CC(C)CCc1ccc(NC(=O)NCC(C)c2ccncc2)nc1 |
|
|
C774
|
Cc1cnccc1NCc1cncs1 |
|
|
C775
|
CNc1ccnc(NCc2cncs2)c1 |
|
|
C776
|
Nc1cnccc1NCc1cncs1 |
|
|
C778
|
NNc1cc(NCc2cncs2)ccn1 |
|
|
C779
|
CC(C)C(CNC(=O)Cc1ccc[nH]1)NC(=O)c1ccncc1 |
|
|
C780
|
Cc1ccnc(NC(=O)NCC(C)c2ccccn2)c1 |
|
|
C781
|
NC(Cc1cncs1)c1ccc(Cl)cn1 |
|
|
C782
|
COCCNC(=O)CN(C)c1ccc(-c2ccncc2)cn1 |
|
|
C783
|
O=C(O)c1cc(S(=O)(=O)NCc2nccs2)c[nH]1 |
|
|
C784
|
O=C1CN(c2nc(C3CCOC3)ns2)CCN1c1cccnc1 |
|
|
C785
|
CC(=O)NCCC(C)NC(=O)c1csc(-c2ccccn2)n1 |
|
|
C786
|
CCN(CCc1ccccn1)S(=O)(=O)Cc1cccnc1 |
|
|
C787
|
Nc1cc(NCc2c[nH]cn2)ccn1 |
|
|
C788
|
Cc1cnccc1NCc1c[nH]cn1 |
|
|
C789
|
N#Cc1ccc(-c2nccs2)[nH]1 |
|
|
C790
|
CN(c1ccncc1N)n1cccc1 |
|
|
C792
|
COC(C)Cn1ccnc1C(=O)c1ccncc1 |
|
|
C794
|
CC(n1nc(-c2cncs2)nc1-c1cc[nH]c1)C(F)(F)F |
|
|
C797
|
CC(C)(C)CC(Nc1ccncc1F)c1cccnc1 |
|
|
C799
|
CC(Nc1cnc(-n2cccc2)cn1)c1ccccn1 |
|
|
C800
|
COC(=O)CCN(Cc1cccnc1)S(=O)(=O)C1CCOC1 |
|
|
C801
|
CCC(C(=O)Nc1c[nH]nc1-c1ccccn1)n1ccnc1 |
|
|
C802
|
O=C(CCC(=O)c1ccc[nH]1)OC(c1cccnc1)C(F)(F)F |
|
|
C803
|
CCCN(CCNC(=O)c1cccnc1)CCC1CCOC1 |
|
|
C804
|
CC(NCCCNC(=O)C1CCC1)c1cnc(-c2ccccn2)s1 |
|
|
C805
|
CC(NC(C)C1CCCO1)c1ccc(-c2cccnc2)cc1 |
|
|
C806
|
CC(C)CC(NC(=O)c1cnc(-c2ccccn2)s1)C(F)(F)F |
|
|
C807
|
CN(C)S(N)(=O)=NC(=O)c1cnn(C)c1-n1cccc1 |
|
|
C811
|
CCc1nc(-n2cccc2)sc1C(=O)NS(=O)(=O)CC(C)(F)F |
|
|
C812
|
Cn1ncc(C(=O)OCCCCC(C)(F)F)c1-n1cccc1 |
|
|
C813
|
CCc1nc(-n2cccc2)sc1C(=O)OC(C)CC |
|
|
C814
|
O=C(O)C1CCOC1CNCc1cncs1 |
|
|
C815
|
CCC1(C(N)c2cncs2)CCCO1 |
|
|
C816
|
CCC1OCCC1C(N)c1cncs1 |
|
|
C817
|
CNC(c1cncs1)C1CCOC1 |
|
|
C818
|
Cc1cccnc1C(N)Cc1cncs1 |
|
|
C819
|
Cc1ccc(C(N)Cc2cncs2)nc1 |
|
|
C820
|
O=C(CCCN1CCCCC1)Nc1c[nH]nc1-c1nccs1 |
|
|
C821
|
NCC1CC(CNCc2cncs2)CO1 |
|
|
C823
|
O=S(=O)(c1cccnc1)N1CC2CCC(C1)N2C1CCNCC1 |
|
|
C824
|
c1cc(OC2CCN(c3ncnc4ccsc34)C2)ccn1 |
|
|
C825
|
N#Cc1cc(C(=O)OCCN2CCCCC2)c[nH]1 |
|
|
C827
|
O=C(NC(CO)CN1CCCCC1)c1[nH]ncc1C(F)(F)F |
|
|
C828
|
CC(CC(=O)Nc1c[nH]nc1-c1ccccn1)C1CCNCC1 |
|
|
C829
|
CN(C)C(=O)Cn1cc(NS(=O)(=O)N2CCCCC2)cn1 |
|
|
C831
|
CN(C)C(=O)Cn1ccc(NS(=O)(=O)N2CCCCC2)n1 |
|