Compound List
| Compound | Smiles | Mol |
|---|---|---|
|
C1205
|
CC(=O)N(C)c1nc(C=O)cs1 |
|
|
C1206
|
CCNC(C)CCCCOc1cccc2c1OC(C)(C)C2 |
|
|
C1207
|
Cc1cc(N)ccc1N1C(=O)CCC1=O |
|
|
C1208
|
Nc1ccc(NC(=O)NC2CC2)cc1 |
|
|
C1209
|
FC(F)(F)c1ccc(Cl)nc1Cl |
|
|
C1210
|
COc1ccccc1Nc1nc(-c2ccc(-c3ccccc3)cc2)cs1 |
|
|
C1211
|
CC1(C)CNCCO1 |
|
|
C1212
|
CC(C)(C)n1nc(C2CC2)cc1C(=O)O |
|
|
C1213
|
CCC(CC)S(N)(=O)=O |
|
|
C1214
|
O=C(O)C1=NN(c2ccccc2)C(c2ccccc2)C1 |
|
|
C1215
|
CC1(c2cccc(Cl)c2)NC(=O)NC1=O |
|
|
C1216
|
FC(F)Oc1ccc(Br)cc1 |
|
|
C1217
|
CCOCCOC1CCNCC1 |
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|
C1218
|
O=C1Nc2ccc(C(=O)O)cc2C1=O |
|
|
C1219
|
O=C(O)c1cc2c([nH]c1=O)CCC2 |
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|
C1220
|
BrCCc1ccc2ccccc2c1 |
|
|
C1221
|
O=Cc1cc(Cl)ccc1Br |
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|
C1222
|
CC(C)COCC(C)N |
|
|
C1223
|
Cc1c(N)cccc1C(=O)N1CCCC1 |
|
|
C1224
|
O=C(Cc1ncc[nH]1)c1ccc(Cl)cc1F |
|
|
C1225
|
CC(C)C(=O)Nc1ccc(N)cc1 |
|
|
C1226
|
O=C(O)C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1 |
|
|
C1227
|
Cc1n[nH]c(-c2ccccc2I)n1 |
|
|
C1228
|
CNC(=O)NC(=O)CCl |
|
|
C1229
|
Clc1nccc2occc12 |
|
|
C1230
|
CNC(=O)CCN |
|
|
C1231
|
CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(C=O)cs1 |
|
|
C1232
|
NCc1ccc(N2CCCCC2CCO)nc1 |
|
|
C1233
|
O=C(O)CSc1ccc(C(=O)O)cc1[N+](=O)[O-] |
|
|
C1234
|
N#CCc1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1 |
|
|
C1235
|
Nc1cc(Br)cc(C(F)(F)F)c1 |
|
|
C1236
|
CN(C)c1ccc(C#N)cn1 |
|
|
C1237
|
CC(C)CCC(N)C(C)(C)C |
|
|
C1238
|
O=C(O)c1cccc(NC(=O)c2cccs2)c1 |
|
|
C1239
|
Cn1c(S)nnc1N1CCOCC1 |
|
|
C1240
|
ON=Cc1ccc(-n2ccnc2)c(F)c1 |
|
|
C1241
|
c1ccc2c(c1)c1ccccc1n2CC1CO1 |
|
|
C1242
|
CN1CCN(C(=O)c2ccccc2C(=O)O)CC1 |
|
|
C1243
|
O=C(O)C1CCCOC1 |
|
|
C1244
|
COc1cc(C=NO)ccc1OC(F)F |
|
|
C1245
|
OCCC1CCCCC1 |
|
|
C1246
|
NNC(=O)NC1CCCCC1 |
|
|
C1247
|
C1CCC2NC2C1 |
|
|
C1248
|
NC(=O)c1cccc(CO)c1 |
|
|
C1249
|
O=C(O)c1ccc2ncccc2c1 |
|
|
C1250
|
O=C1CCNc2ccc(F)cc21 |
|
|
C1251
|
NC(=O)Cc1ccc(Cl)c(Cl)c1 |
|
|
C1252
|
COC(=O)C(=O)CC(=O)c1ccc(N2CCOCC2)cc1 |
|
|
C1253
|
COc1ccc(Cl)cc1NC(=O)COc1ccc(C(=O)O)cc1OC |
|
|
C1254
|
CC1CCCCN1CC(=O)Nc1ccc(F)c(N)c1 |
|
|
C1255
|
COc1ccc(-c2cc(C(=O)O)c3ccccc3n2)cc1OC |
|
|
C1256
|
CCCCOc1ccc(-c2cc(N)on2)cc1 |
|
|
C1257
|
NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Cl |
|
|
C1258
|
CCCCNCc1ccccc1F |
|
|
C1259
|
OC1CCNC1 |
|
|
C1260
|
COC(=O)C(CN)c1ccc(C)cc1 |
|
|
C1261
|
CCN(CC)C(=O)C(C)N |
|
|
C1262
|
COc1cc(SC)ccc1C(=O)O |
|
|
C1263
|
O=C(O)c1cc2cc(Br)ccc2[nH]1 |
|
|
C1264
|
CC(C)(C)OC(=O)NC1CC2(CC(=O)C2)C1 |
|
|
C1265
|
NCCc1ccccn1 |
|
|
C1266
|
NC(=O)C(Cl)c1ccc(Br)cc1 |
|
|
C1267
|
COc1cccc(C2=CCNCC2)c1 |
|
|
C1268
|
COc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)O)cc1OC |
|
|
C1269
|
NCc1ccnc(-n2cccn2)c1 |
|
|
C1270
|
CCNc1cccc(CO)c1 |
|
|
C1271
|
CCc1cc(C#N)c(N)s1 |
|
|
C1272
|
CC(C)OC(=O)C1(C(=O)OC(C)C)CC(=O)C1 |
|
|
C1273
|
Cc1cc(C=C(C#N)C(=O)O)c(C)n1CC1CCCO1 |
|
|
C1274
|
CNCC(O)c1ccc(F)cc1 |
|
|
C1275
|
COc1cc(C(=O)O)ccc1OCC(=O)N1CCOCC1 |
|
|
C1276
|
O=C(O)c1cn(-c2ccccc2C(F)(F)F)nn1 |
|
|
C1277
|
CC(C)Oc1ccc(C#N)cc1N |
|
|
C1278
|
NC(CCOc1ccccc1)c1ccc(Cl)cc1 |
|
|
C1279
|
COC(=O)N1CCCC(N)C1 |
|
|
C1280
|
CC(=O)c1ccc(N2CCOCC2)cc1 |
|
|
C1281
|
O=C(Cl)Cc1c(Cl)cccc1Cl |
|
|
C1282
|
Nc1ccc(Oc2ccccc2)nc1 |
|
|
C1283
|
NCC1CCS(=O)(=O)C1 |
|
|
C1284
|
O=C(O)CN1C(=O)CCCc2ccccc21 |
|
|
C1285
|
CCC(=O)CC(=O)C1CC1 |
|
|
C1286
|
Nc1cccc(N2CCN(CC3CC3)CC2)c1 |
|
|
C1287
|
Cc1ccc(N)c2[nH]ncc12 |
|
|
C1288
|
O=C(O)CN1CCCC1=O |
|
|
C1289
|
CN(C1CCCCC1)S(=O)(=O)c1cccc(C(=O)O)c1 |
|
|
C1290
|
O=C(O)CCCc1ccc(Cl)cc1 |
|
|
C1291
|
Nc1ccc(Cl)c(S(=O)(=O)N2CCOCC2)c1 |
|
|
C1292
|
O=C(O)c1cccc(CO)c1 |
|
|
C1293
|
NNc1ncnc2sccc12 |
|
|
C1294
|
COc1cccc(-c2nnn[nH]2)c1 |
|
|
C1295
|
CC(C)(C)C(=O)N=C=O |
|
|
C1296
|
NC(=S)C1CN(Cc2ccccc2)CCO1 |
|
|
C1297
|
CC(O)c1cnn(C)c1 |
|
|
C1298
|
CCn1c(=O)n(CCC(=O)O)c2ccccc21 |
|
|
C1299
|
CC(C)C(NS(=O)(=O)c1ccccc1F)C(=O)O |
|
|
C1300
|
Nc1ccc(NC(=O)CN2CCOCC2)cc1 |
|
|
C1301
|
CC(C)CNc1c(N)n(Cc2ccccc2)c(=O)[nH]c1=O |
|
|
C1302
|
O=C(CCl)Nc1cccc(N2CCCC2=O)c1 |
|
|
C1303
|
Cc1cc(Cl)c(N)c(C(=O)O)c1 |
|
|
C1304
|
N#Cc1c(NC(=O)CCl)oc(-c2cccs2)c1-c1cccs1 |
|