Molecular Properties | |
SMILES: | O=C(CCl)N1CC2CC1CN2Cc1ccc(Cl)s1 |
MW: | 304.02 |
Fraction sp3: | 0.58 |
HBA: | 3 |
HBD: | 0 |
Rotatable Bonds: | 3 |
TPSA: | 23.55 |
cLogP: | 2.43 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✔️ |
MAK-UNK-3f402c2b-21
0.712
MAK-UNK-3f402c2b-26
0.613
MAK-UNK-3f402c2b-22
0.547
MAK-UNK-df1a028e-8
0.540
DAN-LON-a5fc619e-8
0.530
MAK-UNK-ec98eaf6-11
0.513
MAK-UNK-df1a028e-6
0.507
MAK-UNK-3f402c2b-3
0.500
MAK-UNK-df1a028e-1
0.486
MAK-UNK-ec98eaf6-14
0.479
SAD-SAT-581007d4-9
0.471
MAK-UNK-ec98eaf6-2
0.468
MAK-UNK-3f402c2b-14
0.466
MAK-UNK-5d2caa6f-6
0.462
MAK-UNK-5d2caa6f-7
0.462
SAD-SAT-581007d4-10
0.459
MAK-UNK-3f402c2b-24
0.457
DAR-DIA-3e9bbd81-1
0.455
MAK-UNK-bae89c02-4
0.453
MAK-UNK-ec98eaf6-17
0.449
MAK-UNK-10799360-21
0.439
MAK-UNK-ec98eaf6-10
0.432
DAR-DIA-3e9bbd81-4
0.422
DAR-DIA-3e9bbd81-10
0.422
MAK-UNK-10799360-22
0.420
MAK-UNK-ec98eaf6-24
0.420
MAK-UNK-bae89c02-3
0.420
MAK-UNK-ec98eaf6-21
0.415
DAR-DIA-3e9bbd81-2
0.415
MAK-UNK-3f402c2b-29
0.414
MAK-UNK-10799360-20
0.412
MAK-UNK-10799360-17
0.410
MAK-UNK-ec98eaf6-57
0.410
MAK-UNK-10799360-16
0.410
AAR-POS-0daf6b7e-2
0.409
MAK-UNK-ec98eaf6-16
0.407
MAK-UNK-ec98eaf6-22
0.407
MAK-UNK-ec98eaf6-7
0.405
MAK-UNK-10799360-19
0.402
MAK-UNK-10799360-12
0.400
MAK-UNK-ec98eaf6-23
0.398
MAK-UNK-10799360-10
0.396
MAK-UNK-10799360-6
0.395
MAK-UNK-3f402c2b-4
0.391
MAK-UNK-3f402c2b-7
0.391
MAK-UNK-5d2caa6f-23
0.391
MAK-UNK-ec98eaf6-20
0.388
SEA-TRI-8252c13b-1
0.388
DAR-DIA-3e9bbd81-8
0.386
DAR-DIA-3e9bbd81-9
0.386
MAK-UNK-10799360-4
0.386
MAK-UNK-3f402c2b-25
0.386
MAK-UNK-90d0606b-1
0.378
MAK-UNK-ec98eaf6-47
0.378
MAK-UNK-10799360-29
0.378
MAK-UNK-3f402c2b-15
0.375
MAK-UNK-10799360-32
0.375
MAK-UNK-ec98eaf6-19
0.369
MAK-UNK-ec98eaf6-13
0.368
MAK-UNK-ec98eaf6-25
0.368
MAK-UNK-10799360-8
0.365
MAK-UNK-df1a028e-4
0.364
MAK-UNK-3f402c2b-27
0.361
MAK-UNK-df1a028e-9
0.361
MAK-UNK-3f402c2b-1
0.360
MAK-UNK-3f402c2b-6
0.360
MAK-UNK-10799360-23
0.360
PEI-IMP-e4a008a2-1
0.356
MAK-UNK-3e0761f8-10
0.354
MAK-UNK-3f402c2b-5
0.351
MAK-UNK-ec98eaf6-28
0.351
MAK-UNK-10799360-36
0.351
MAK-UNK-3f402c2b-9
0.347
SAD-SAT-3a925b8b-8
0.347
MAK-UNK-3f402c2b-12
0.346
MAK-UNK-ec98eaf6-4
0.346
MAK-UNK-ec98eaf6-49
0.345
MAK-UNK-ec98eaf6-3
0.341
AHN-SAT-721e3e40-1
0.341
MAK-UNK-5d2caa6f-5
0.341
MAK-UNK-5d2caa6f-3
0.333
MAK-UNK-3f402c2b-11
0.333
MAK-UNK-10799360-30
0.330
MAK-UNK-3f402c2b-2
0.329
MAK-UNK-5d2caa6f-12
0.329
MAK-UNK-10799360-26
0.327
MAK-UNK-10799360-1
0.325
MAK-UNK-3f402c2b-17
0.325
JOH-UNI-27ac80fd-28
0.325
DAR-DIA-3e9bbd81-3
0.321
MAK-UNK-90d0606b-7
0.321
MAK-UNK-ec98eaf6-6
0.321
MAK-UNK-3f402c2b-13
0.317
MAK-UNK-5d2caa6f-4
0.317
MAK-UNK-5d2caa6f-24
0.315
MAK-UNK-90d0606b-3
0.313
MAK-UNK-ec98eaf6-1
0.310
MAK-UNK-ec98eaf6-51
0.309
MAK-UNK-ec98eaf6-50
0.308
JOH-UNI-27ac80fd-29
0.308