Molecular Properties | |
SMILES: | O=C(CCl)N1CC2CC1CN2S(=O)(=O)c1ccccc1 |
MW: | 314.05 |
Fraction sp3: | 0.46 |
HBA: | 3 |
HBD: | 0 |
Rotatable Bonds: | 3 |
TPSA: | 57.69 |
cLogP: | 0.9 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
Hetero_hetero
MAK-UNK-3f402c2b-15
0.719
MAK-UNK-3f402c2b-5
0.707
MAK-UNK-3f402c2b-2
0.651
MAK-UNK-3f402c2b-11
0.609
MAK-UNK-3f402c2b-9
0.587
MAK-UNK-10799360-35
0.587
MAK-UNK-3f402c2b-1
0.578
MAK-UNK-3f402c2b-24
0.554
MAK-UNK-3f402c2b-13
0.551
SAD-SAT-3a925b8b-8
0.538
MAK-UNK-3f402c2b-12
0.529
MAK-UNK-3f402c2b-17
0.522
MAK-UNK-df1a028e-9
0.448
MAR-TRE-6a44bbf2-21
0.422
MAK-UNK-7c9d1431-9
0.422
MAK-UNK-90d0606b-3
0.421
MAK-UNK-5d2caa6f-3
0.411
MAK-UNK-5d2caa6f-12
0.405
MAK-UNK-df1a028e-4
0.405
MAK-UNK-3f402c2b-6
0.403
MAK-UNK-3f402c2b-7
0.397
MAK-UNK-3f402c2b-29
0.397
MAK-UNK-3f402c2b-25
0.391
MAK-UNK-5d2caa6f-4
0.390
MAK-UNK-3f402c2b-27
0.386
MAK-UNK-bae89c02-4
0.385
MAK-UNK-3f402c2b-3
0.384
MAK-UNK-5d2caa6f-24
0.381
MAK-UNK-3f402c2b-22
0.380
MAK-UNK-5d2caa6f-5
0.380
MAK-UNK-df1a028e-7
0.378
MAK-UNK-3f402c2b-4
0.377
MAK-UNK-3f402c2b-14
0.377
DAR-DIA-3e9bbd81-3
0.375
MAK-UNK-3f402c2b-26
0.375
MAK-UNK-3e0761f8-9
0.375
MAK-UNK-ec98eaf6-11
0.373
MAK-UNK-bae89c02-3
0.373
DAN-LON-a5fc619e-8
0.370
MAK-UNK-90d0606b-1
0.366
MAK-UNK-3e0761f8-8
0.365
DAR-DIA-3e9bbd81-4
0.360
MAK-UNK-3f402c2b-16
0.356
MAK-UNK-ec98eaf6-13
0.355
MAK-UNK-10799360-36
0.355
SAD-SAT-581007d4-10
0.354
DAR-DIA-3e9bbd81-7
0.353
MAK-UNK-ec98eaf6-2
0.353
MAK-UNK-df1a028e-8
0.352
MAK-UNK-10799360-29
0.352
MAK-UNK-3f402c2b-21
0.351
MAK-UNK-3f402c2b-18
0.351
MAK-UNK-ec98eaf6-4
0.351
MAK-UNK-ec98eaf6-49
0.349
MAK-UNK-10799360-30
0.348
MAK-UNK-5d2caa6f-20
0.347
MAK-UNK-ec98eaf6-7
0.345
MAK-UNK-3e0761f8-4
0.341
MAK-UNK-ec98eaf6-19
0.341
GIA-UNK-5ec6c2b8-4
0.338
DUN-NEW-f8ce3686-22
0.338
MAK-UNK-df1a028e-1
0.338
DAR-DIA-3e9bbd81-1
0.337
DAR-DIA-3e9bbd81-5
0.337
MAK-UNK-10799360-6
0.337
MAK-UNK-df1a028e-6
0.333
MAK-UNK-10799360-16
0.333
MAK-UNK-10799360-17
0.333
DAR-DIA-3e9bbd81-8
0.330
DAR-DIA-3e9bbd81-10
0.330
MAK-UNK-10799360-21
0.330
MAK-UNK-5d2caa6f-7
0.329
MAK-UNK-10799360-5
0.329
MAK-UNK-ec98eaf6-48
0.329
AHN-SAT-721e3e40-1
0.329
MAK-UNK-ec98eaf6-3
0.329
MAK-UNK-ec98eaf6-51
0.326
MAK-UNK-df1a028e-2
0.326
MAK-UNK-ec98eaf6-24
0.326
MAK-UNK-ec98eaf6-20
0.325
JOE-SYG-2c9a1216-1
0.325
MAK-UNK-ec98eaf6-6
0.325
MAK-UNK-ec98eaf6-9
0.325
SAD-SAT-581007d4-9
0.325
PEI-IMP-3d837503-2
0.324
DAR-DIA-3e9bbd81-6
0.323
DAN-MCD-1c3944e2-1
0.322
MAK-UNK-10799360-20
0.322
DAR-DIA-3e9bbd81-2
0.322
MAK-UNK-ec98eaf6-14
0.321
MAC-MCD-4707377b-1
0.321
MAK-UNK-3f402c2b-19
0.321
PEI-IMP-3d837503-4
0.319
MAK-UNK-df1a028e-5
0.316
MAK-UNK-10799360-26
0.316
DAN-MCD-34fd4f29-1
0.315
DAR-DIA-3e9bbd81-9
0.315
MAK-UNK-10799360-4
0.315
MAK-UNK-ec98eaf6-1
0.314
SAD-SAT-65574d3f-3
0.312