Molecular Properties | |
SMILES: | NS(=O)(=O)Cc1nc2cccc(CN3CC4CC3CN4C(=O)CCl)c2[nH]1 |
MW: | 397.1 |
Fraction sp3: | 0.5 |
HBA: | 5 |
HBD: | 2 |
Rotatable Bonds: | 5 |
TPSA: | 112.39 |
cLogP: | 0.38 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✔️ |
MED-COV-4280ac29-15
STU-CHA-0f79177c-1
0.557
MAK-UNK-bae89c02-4
0.506
MAK-UNK-bae89c02-3
0.489
MAK-UNK-10799360-6
0.479
DAR-DIA-3e9bbd81-4
0.474
MAK-UNK-3f402c2b-14
0.466
MAK-UNK-df1a028e-1
0.465
DAR-DIA-3e9bbd81-8
0.455
MAK-UNK-ec98eaf6-47
0.446
DAR-DIA-3e9bbd81-10
0.443
DAR-DIA-3e9bbd81-9
0.426
DAR-DIA-3e9bbd81-1
0.426
MAK-UNK-3f402c2b-26
0.419
MAK-UNK-df1a028e-8
0.417
MAK-UNK-5d2caa6f-6
0.417
MAK-UNK-10799360-21
0.414
DAN-LON-a5fc619e-8
0.414
SAD-SAT-581007d4-10
0.413
MAK-UNK-3f402c2b-3
0.409
DAR-DIA-3e9bbd81-2
0.408
MAK-UNK-ec98eaf6-21
0.408
MAK-UNK-3f402c2b-22
0.407
MAK-UNK-5d2caa6f-7
0.402
MAK-UNK-ec98eaf6-7
0.400
MAK-UNK-ec98eaf6-24
0.398
MAK-UNK-3f402c2b-21
0.398
MAK-UNK-3e0761f8-10
0.393
MAK-UNK-10799360-20
0.392
MAK-UNK-ec98eaf6-17
0.392
MAK-UNK-10799360-29
0.390
MAK-UNK-ec98eaf6-22
0.388
MAK-UNK-ec98eaf6-16
0.388
MAK-UNK-3f402c2b-16
0.386
MAK-UNK-10799360-22
0.384
MAK-UNK-df1a028e-6
0.382
MAK-UNK-10799360-17
0.376
MAK-UNK-10799360-10
0.367
MAK-UNK-ec98eaf6-10
0.366
MAK-UNK-ec98eaf6-23
0.366
MAK-UNK-10799360-16
0.363
SAD-SAT-581007d4-9
0.359
MAK-UNK-90d0606b-7
0.357
MAK-UNK-ec98eaf6-11
0.356
MAK-UNK-ec98eaf6-14
0.354
MAK-UNK-10799360-8
0.354
MAK-UNK-ec98eaf6-2
0.353
MAK-UNK-5d2caa6f-23
0.351
MAK-UNK-10799360-23
0.350
MAK-UNK-ec98eaf6-57
0.350
MAK-UNK-10799360-12
0.345
MAK-UNK-ec98eaf6-19
0.343
MAK-UNK-90d0606b-1
0.337
MAK-UNK-ec98eaf6-25
0.333
MAK-UNK-10799360-19
0.333
MAK-UNK-ec98eaf6-28
0.330
MAK-UNK-ec98eaf6-20
0.330
MAK-UNK-3f402c2b-9
0.323
MAK-UNK-3f402c2b-1
0.319
MAK-UNK-10799360-32
0.316
PEI-IMP-e4a008a2-1
0.315
MAK-UNK-3f402c2b-13
0.313
MAK-UNK-10799360-30
0.312
MAK-UNK-3f402c2b-7
0.311
MAK-UNK-10799360-26
0.310
MAK-UNK-5d2caa6f-12
0.309
MAK-UNK-3f402c2b-2
0.309
MAK-UNK-ec98eaf6-4
0.309
MAK-UNK-3f402c2b-25
0.308
MAK-UNK-10799360-5
0.308
MAK-UNK-3f402c2b-24
0.305
MAK-UNK-3f402c2b-27
0.304
MAK-UNK-10799360-35
0.303
MAK-UNK-3f402c2b-15
0.301
MAK-UNK-3f402c2b-29
0.300
MAK-UNK-3f402c2b-11
0.299
MAK-UNK-ec98eaf6-13
0.299
MAK-UNK-3f402c2b-5
0.298
MAK-UNK-90d0606b-3
0.297
MAK-UNK-3f402c2b-12
0.296
AHN-SAT-721e3e40-1
0.294
MAK-UNK-3e0761f8-4
0.292
MAK-UNK-df1a028e-9
0.290
MAK-UNK-10799360-36
0.286
MAK-UNK-df1a028e-4
0.283
MAK-UNK-3f402c2b-4
0.283
MAK-UNK-ec98eaf6-3
0.282
SAD-SAT-3a925b8b-8
0.281
MAK-UNK-3f402c2b-17
0.280
MAK-UNK-3f402c2b-6
0.278
DAR-DIA-3e9bbd81-7
0.278
MAK-UNK-ec98eaf6-36
0.278
MAK-UNK-10799360-14
0.276
MAK-UNK-ec98eaf6-15
0.275
MAK-UNK-5d2caa6f-3
0.273
MAK-UNK-ec98eaf6-51
0.272
DAR-DIA-3e9bbd81-13
0.271
MAK-UNK-10799360-13
0.270
MAK-UNK-10799360-1
0.269
MAK-UNK-90d0606b-4
0.268
MAK-UNK-ec98eaf6-53
0.267