Molecular Properties | |
SMILES: | COCCc1ccc(Cl)cc1CN1CC2CC1CN2C(=O)CCl |
MW: | 356.11 |
Fraction sp3: | 0.59 |
HBA: | 3 |
HBD: | 0 |
Rotatable Bonds: | 6 |
TPSA: | 32.78 |
cLogP: | 2.55 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✔️ |
MED-COV-4280ac29-15
MAK-UNK-10799360-12
0.562
MAK-UNK-10799360-10
0.556
MAK-UNK-5d2caa6f-23
0.549
MAK-UNK-10799360-8
0.532
MED-COV-4280ac29-37
0.506
MAK-UNK-df1a028e-1
0.500
MAK-UNK-ec98eaf6-23
0.500
DAN-LON-a5fc619e-8
0.500
MAK-UNK-5d2caa6f-6
0.494
MAK-UNK-ec98eaf6-14
0.494
MAK-UNK-10799360-22
0.488
MAK-UNK-ec98eaf6-24
0.488
DAR-DIA-3e9bbd81-1
0.488
MAK-UNK-df1a028e-8
0.486
MAK-UNK-df1a028e-6
0.481
DAR-DIA-3e9bbd81-4
0.472
MAK-UNK-bae89c02-4
0.470
MAK-UNK-3f402c2b-14
0.463
MAK-UNK-3f402c2b-3
0.456
DAR-DIA-3e9bbd81-10
0.456
MAK-UNK-3f402c2b-22
0.455
SAD-SAT-581007d4-9
0.450
MAK-UNK-ec98eaf6-21
0.449
MAK-UNK-3f402c2b-26
0.449
MAK-UNK-3f402c2b-16
0.449
MAK-UNK-ec98eaf6-22
0.443
MAK-UNK-bae89c02-3
0.438
MAK-UNK-10799360-6
0.430
MAK-UNK-ec98eaf6-57
0.429
MAK-UNK-ec98eaf6-16
0.427
MAK-UNK-3f402c2b-21
0.425
MAK-UNK-10799360-21
0.424
SAD-SAT-581007d4-10
0.424
MAK-UNK-10799360-23
0.419
DAR-DIA-3e9bbd81-2
0.418
MAK-UNK-10799360-20
0.415
MAK-UNK-ec98eaf6-47
0.412
DAR-DIA-3e9bbd81-8
0.406
MAK-UNK-ec98eaf6-25
0.402
MAK-UNK-3e0761f8-10
0.400
MAK-UNK-10799360-17
0.398
MAK-UNK-5d2caa6f-7
0.396
DAR-DIA-3e9bbd81-9
0.392
MAK-UNK-10799360-4
0.392
MAK-UNK-ec98eaf6-10
0.387
MAK-UNK-ec98eaf6-28
0.386
MAK-UNK-90d0606b-1
0.385
MAK-UNK-10799360-16
0.383
MAK-UNK-3f402c2b-27
0.370
MAK-UNK-10799360-29
0.370
MAK-UNK-ec98eaf6-7
0.365
MAK-UNK-ec98eaf6-11
0.362
MAK-UNK-3f402c2b-25
0.358
MAK-UNK-ec98eaf6-2
0.358
HYO-UNK-1dbfcf16-1
0.358
MAK-UNK-3f402c2b-29
0.357
MAK-UNK-ec98eaf6-4
0.356
MAK-UNK-ec98eaf6-3
0.352
MAK-UNK-10799360-19
0.350
MAK-UNK-3f402c2b-15
0.349
MAK-UNK-90d0606b-7
0.348
MAK-UNK-ec98eaf6-20
0.348
MAK-UNK-3f402c2b-4
0.346
MAK-UNK-ec98eaf6-13
0.345
MAK-UNK-10799360-36
0.345
AHN-SAT-721e3e40-1
0.337
MAK-UNK-10799360-26
0.336
MAK-UNK-ec98eaf6-6
0.333
MAK-UNK-ec98eaf6-19
0.333
MAK-UNK-10799360-32
0.330
MAK-UNK-3f402c2b-7
0.329
MAK-UNK-3f402c2b-12
0.326
MAK-UNK-ec98eaf6-1
0.323
MAK-UNK-3f402c2b-17
0.322
MAK-UNK-3f402c2b-1
0.322
MAK-UNK-3f402c2b-24
0.322
MAK-UNK-ec98eaf6-15
0.321
MAK-UNK-ec98eaf6-50
0.320
DAR-DIA-3e9bbd81-3
0.319
MAK-UNK-3f402c2b-11
0.315
MAK-UNK-10799360-30
0.314
MAK-UNK-3f402c2b-5
0.314
MAK-UNK-ec98eaf6-49
0.313
MAK-UNK-df1a028e-4
0.311
MAK-UNK-3f402c2b-9
0.310
MAK-UNK-3f402c2b-6
0.307
MAK-UNK-df1a028e-9
0.306
MAK-UNK-5d2caa6f-16
0.303
PEI-IMP-e4a008a2-1
0.302
MAK-UNK-ec98eaf6-45
0.302
MAK-UNK-90d0606b-2
0.301
MAK-UNK-3f402c2b-13
0.301
MAK-UNK-3f402c2b-2
0.297
MAK-UNK-5d2caa6f-12
0.297
MAK-UNK-10799360-5
0.296
STU-CHA-7b3b91d5-1
0.295
MAK-UNK-90d0606b-8
0.292
MAK-UNK-ec98eaf6-9
0.292
MAK-UNK-ec98eaf6-44
0.290
MAK-UNK-90d0606b-10
0.289