Molecular Properties | |
SMILES: | CNCc1cc(-c2ccc(-c3ccccc3)nc2)n(S(=O)(=O)c2cccnc2)c1 |
MW: | 404.495 |
Fraction sp3: | 0.09 |
HBA: | 6 |
HBD: | 1 |
Rotatable Bonds: | 6 |
TPSA: | 76.88 |
cLogP: | 3.5685 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✔️ |
MAK-UNK-0955449e-32
0.596
ANT-OPE-a517596a-1
0.524
MAK-UNK-de9577cf-4
0.471
MAK-UNK-0955449e-34
0.464
MAK-UNK-de9577cf-5
0.458
MAK-UNK-148caf23-21
0.454
MAK-UNK-148caf23-22
0.444
MAK-UNK-9a6be56d-6
0.438
MAK-UNK-9a6be56d-22
0.435
MAK-UNK-de9577cf-7
0.431
MAK-UNK-148caf23-23
0.431
MAK-UNK-de9577cf-9
0.423
MAK-UNK-148caf23-20
0.423
MAK-UNK-9a6be56d-23
0.422
MAK-UNK-de9577cf-6
0.418
MAK-UNK-9a6be56d-24
0.417
MAK-UNK-de9577cf-8
0.414
MAK-UNK-8fdbca50-26
0.412
MAK-UNK-148caf23-6
0.411
MAK-UNK-8fdbca50-28
0.407
MAK-UNK-9a6be56d-21
0.403
MAK-UNK-8fdbca50-30
0.402
MAK-UNK-148caf23-4
0.398
MAK-UNK-0955449e-35
0.397
MAK-UNK-9a6be56d-2
0.395
MAK-UNK-8fdbca50-27
0.395
MAK-UNK-8fdbca50-13
0.393
MAK-UNK-148caf23-2
0.391
MAK-UNK-148caf23-7
0.391
MAK-UNK-8fdbca50-11
0.390
MAK-UNK-148caf23-5
0.389
MAK-UNK-8fdbca50-14
0.388
MAK-UNK-8fdbca50-31
0.388
MAK-UNK-148caf23-3
0.386
MAK-UNK-148caf23-8
0.386
MAK-UNK-de9577cf-1
0.384
MAK-UNK-148caf23-1
0.383
MAK-UNK-8fdbca50-15
0.376
MAK-UNK-8fdbca50-12
0.376
MAK-UNK-de9577cf-10
0.368
MAK-UNK-148caf23-9
0.365
MAK-UNK-9a6be56d-27
0.364
MAK-UNK-8fdbca50-40
0.364
MAK-UNK-de9577cf-11
0.363
MAK-UNK-9a6be56d-26
0.358
MAK-UNK-de9577cf-2
0.355
MAK-UNK-de9577cf-22
0.350
MAK-UNK-148caf23-14
0.350
MAK-UNK-9a6be56d-30
0.350
MAK-UNK-8fdbca50-38
0.347
MAK-UNK-9a6be56d-28
0.347
MAK-UNK-8fdbca50-1
0.346
MAK-UNK-8fdbca50-34
0.346
MAK-UNK-9a6be56d-25
0.346
MAK-UNK-8fdbca50-33
0.344
MAK-UNK-8fdbca50-32
0.344
MAK-UNK-8fdbca50-39
0.344
MAK-UNK-8fdbca50-37
0.344
MAK-UNK-9a6be56d-32
0.341
MAK-UNK-702fb7d3-5
0.341
MAK-UNK-8fdbca50-16
0.341
MAK-UNK-8fdbca50-35
0.341
MAK-UNK-9a6be56d-14
0.339
MAK-UNK-9a6be56d-31
0.339
MAK-UNK-9a6be56d-29
0.339
MAK-UNK-702fb7d3-11
0.338
MAK-UNK-9a6be56d-3
0.336
MAK-UNK-702fb7d3-6
0.336
MAK-UNK-702fb7d3-7
0.336
MAK-UNK-8fdbca50-36
0.333
MAK-UNK-8fdbca50-41
0.333
MAK-UNK-702fb7d3-3
0.333
MAK-UNK-de9577cf-19
0.333
MAK-UNK-702fb7d3-2
0.333
MAK-UNK-702fb7d3-9
0.333
MAK-UNK-148caf23-16
0.333
MAK-UNK-9a6be56d-1
0.331
MAK-UNK-9a6be56d-16
0.328
MAK-UNK-8fdbca50-2
0.328
MAK-UNK-148caf23-10
0.328
MAK-UNK-702fb7d3-8
0.326
MAK-UNK-702fb7d3-4
0.326
MAK-UNK-8fdbca50-23
0.325
MAK-UNK-148caf23-15
0.325
MAK-UNK-148caf23-17
0.325
MAK-UNK-148caf23-18
0.325
MAK-UNK-702fb7d3-10
0.323
MAK-UNK-702fb7d3-1
0.323
MAK-UNK-8fdbca50-20
0.323
MAK-UNK-9a6be56d-17
0.323
MAK-UNK-702fb7d3-13
0.321
MAK-UNK-702fb7d3-14
0.321
MAK-UNK-8fdbca50-17
0.320
MAK-UNK-9a6be56d-8
0.320
MAK-UNK-de9577cf-17
0.319
MAK-UNK-148caf23-11
0.319
MAK-UNK-702fb7d3-12
0.318
MAK-UNK-702fb7d3-19
0.318
MAK-UNK-8fdbca50-5
0.315
MAK-UNK-9a6be56d-10
0.315