Molecular Properties | |
SMILES: | Cc1cccc(C(CNS(C)(=O)=O)N2CC3CC2CN3C(=O)CCl)c1 |
MW: | 385.12 |
Fraction sp3: | 0.59 |
HBA: | 4 |
HBD: | 1 |
Rotatable Bonds: | 6 |
TPSA: | 69.72 |
cLogP: | 1.11 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✔️ |
Hetero_hetero
MED-COV-4280ac29-15
MAK-UNK-90d0606b-3
0.722
MAK-UNK-ec98eaf6-9
0.556
SEL-UNI-cd366922-9
0.537
MAK-UNK-ec98eaf6-1
0.536
AHN-SAT-721e3e40-1
0.506
MAK-UNK-ec98eaf6-50
0.506
MAK-UNK-ec98eaf6-53
0.489
MAK-UNK-ec98eaf6-49
0.467
MAK-UNK-ec98eaf6-51
0.453
MAK-UNK-10799360-36
0.451
MAK-UNK-df1a028e-9
0.449
MAK-UNK-3f402c2b-3
0.444
MAK-UNK-ec98eaf6-52
0.440
MAK-UNK-5d2caa6f-5
0.437
MAK-UNK-5d2caa6f-3
0.434
MAK-UNK-3e0761f8-9
0.432
MAK-UNK-5d2caa6f-4
0.430
MAK-UNK-ec98eaf6-6
0.416
DAR-DIA-3e9bbd81-3
0.416
DAR-DIA-3e9bbd81-7
0.409
MAK-UNK-3f402c2b-17
0.407
MAK-UNK-df1a028e-4
0.395
MAK-UNK-3f402c2b-12
0.395
MAK-UNK-5d2caa6f-24
0.389
MAK-UNK-10799360-5
0.387
MAK-UNK-3f402c2b-5
0.386
MAK-UNK-3f402c2b-27
0.378
DAR-DIA-3e9bbd81-5
0.378
MAK-UNK-ec98eaf6-15
0.377
MAK-UNK-ec98eaf6-32
0.375
MAK-UNK-3f402c2b-4
0.370
MAK-UNK-ec98eaf6-13
0.368
MAK-UNK-ec98eaf6-55
0.363
DAR-DIA-3e9bbd81-6
0.363
DAR-DIA-3e9bbd81-14
0.363
DAR-DIA-3e9bbd81-13
0.362
SEL-UNI-cd366922-2
0.360
MAK-UNK-ec98eaf6-3
0.359
MAK-UNK-ec98eaf6-8
0.358
MAK-UNK-3f402c2b-9
0.349
DAN-LON-a5fc619e-8
0.349
MAK-UNK-3f402c2b-2
0.348
MAK-UNK-ec98eaf6-54
0.342
PEI-IMP-e4a008a2-1
0.341
MAK-UNK-ec98eaf6-56
0.336
MAK-UNK-df1a028e-5
0.333
MAK-UNK-10799360-17
0.333
MAK-UNK-10799360-3
0.330
MAK-UNK-3f402c2b-1
0.330
MAK-UNK-3f402c2b-29
0.329
MAK-UNK-3f402c2b-15
0.326
MAK-UNK-10799360-34
0.323
MAK-UNK-3f402c2b-13
0.323
SAD-SAT-581007d4-10
0.323
MAK-UNK-3f402c2b-11
0.322
MED-COV-4280ac29-23
0.322
MAK-UNK-3f402c2b-7
0.321
MAK-UNK-10799360-16
0.320
MAK-UNK-af83ef51-9
0.319
MAK-UNK-ec98eaf6-4
0.319
SAD-SAT-3a925b8b-8
0.318
MAK-UNK-df1a028e-8
0.318
MAK-UNK-3f402c2b-25
0.318
MAK-UNK-af83ef51-5
0.315
MAK-UNK-3f402c2b-24
0.315
MAK-UNK-bae89c02-3
0.313
MAK-UNK-3e0761f8-5
0.312
MIH-UNI-e573136b-7
0.312
MAK-UNK-ec98eaf6-43
0.311
GIA-UNK-7337c2f3-8
0.311
MAK-UNK-3f402c2b-22
0.310
MAK-UNK-ec98eaf6-10
0.310
MAK-UNK-3f402c2b-26
0.307
MAK-UNK-90d0606b-1
0.306
MAK-UNK-bae89c02-4
0.305
MED-COV-4280ac29-7
0.304
DAR-DIA-3e9bbd81-4
0.304
MAK-UNK-df1a028e-6
0.303
MAK-UNK-10799360-10
0.303
MAK-UNK-af83ef51-7
0.302
MAK-UNK-3f402c2b-6
0.300
MAK-UNK-ec98eaf6-19
0.300
MAK-UNK-af83ef51-8
0.300
MAK-UNK-10799360-29
0.299
MAK-UNK-ec98eaf6-47
0.299
SAD-SAT-c989feaa-8
0.299
MAK-UNK-90d0606b-8
0.299
MAK-UNK-10799360-20
0.298
MAK-UNK-10799360-35
0.298
MAK-UNK-3f402c2b-14
0.298
MAK-UNK-ec98eaf6-21
0.297
SAD-SAT-581007d4-9
0.297
MAK-UNK-ec98eaf6-42
0.296
MAK-UNK-af83ef51-6
0.295
MAK-UNK-ec98eaf6-14
0.295
MAK-UNK-df1a028e-1
0.293
MAK-UNK-10799360-4
0.292
MAK-UNK-10799360-19
0.292
DAR-DIA-3e9bbd81-8
0.292
MAK-UNK-3f402c2b-16
0.292