Molecular Properties | |
SMILES: | CNCc1cc(-c2cccc(N(C(=O)C3CCN(C(=O)CCl)CC3)C(C)C)c2F)n(S(=O)(=O)c2cccnc2)c1 |
MW: | 590.121 |
Fraction sp3: | 0.39 |
HBA: | 7 |
HBD: | 1 |
Rotatable Bonds: | 9 |
TPSA: | 104.61 |
cLogP: | 3.8644 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
Activated haloaromatics
AAR-POS-d2a4d1df-5
MAK-UNK-8fdbca50-31
0.748
MAK-UNK-8fdbca50-28
0.745
MAK-UNK-8fdbca50-30
0.743
MAK-UNK-8fdbca50-12
0.722
MAK-UNK-8fdbca50-13
0.661
MAK-UNK-8fdbca50-14
0.658
MAK-UNK-8fdbca50-26
0.658
MAK-UNK-8fdbca50-11
0.642
MAK-UNK-8fdbca50-22
0.605
MAK-UNK-8fdbca50-24
0.603
MAK-UNK-8fdbca50-23
0.602
MAK-UNK-8fdbca50-16
0.598
MAK-UNK-8fdbca50-15
0.597
MAK-UNK-8fdbca50-21
0.595
MAK-UNK-8fdbca50-1
0.589
MAK-UNK-8fdbca50-40
0.579
MAK-UNK-8fdbca50-41
0.577
MAK-UNK-8fdbca50-17
0.566
MAK-UNK-8fdbca50-20
0.565
MAK-UNK-8fdbca50-39
0.565
MAK-UNK-8fdbca50-2
0.561
MAK-UNK-8fdbca50-5
0.551
MAK-UNK-8fdbca50-9
0.548
MAK-UNK-8fdbca50-25
0.544
MAK-UNK-8fdbca50-18
0.540
MAK-UNK-8fdbca50-32
0.540
MAK-UNK-8fdbca50-3
0.540
MAK-UNK-8fdbca50-8
0.535
MAK-UNK-8fdbca50-7
0.527
MAK-UNK-8fdbca50-34
0.515
MAK-UNK-8fdbca50-37
0.511
MAK-UNK-8fdbca50-33
0.504
MAK-UNK-8fdbca50-6
0.504
MAK-UNK-de9577cf-6
0.492
MAK-UNK-8fdbca50-36
0.489
MAK-UNK-8fdbca50-10
0.485
MAK-UNK-8fdbca50-38
0.485
MAK-UNK-8fdbca50-19
0.469
MAK-UNK-8fdbca50-35
0.466
MAK-UNK-148caf23-20
0.460
MAK-UNK-de9577cf-4
0.455
MAK-UNK-9a6be56d-21
0.451
MAK-UNK-8fdbca50-4
0.437
MAK-UNK-0955449e-32
0.436
MAK-UNK-702fb7d3-8
0.436
MAK-UNK-702fb7d3-9
0.435
MAK-UNK-de9577cf-7
0.433
MAK-UNK-702fb7d3-12
0.429
MAK-UNK-0955449e-34
0.427
MAK-UNK-de9577cf-5
0.422
MAK-UNK-702fb7d3-13
0.420
MAK-UNK-de9577cf-8
0.419
MAK-UNK-702fb7d3-11
0.418
MAK-UNK-702fb7d3-6
0.417
MAK-UNK-9a6be56d-6
0.417
MAK-UNK-9a6be56d-22
0.415
MAK-UNK-702fb7d3-5
0.415
MAK-UNK-0955449e-35
0.413
MAK-UNK-702fb7d3-14
0.411
MAK-UNK-148caf23-21
0.408
MAK-UNK-702fb7d3-10
0.403
MAK-UNK-148caf23-22
0.400
MAK-UNK-702fb7d3-4
0.397
MAK-UNK-702fb7d3-7
0.397
MAK-UNK-0955449e-33
0.395
MAK-UNK-9a6be56d-23
0.394
MAK-UNK-de9577cf-9
0.394
MAK-UNK-9a6be56d-2
0.391
MAK-UNK-9a6be56d-29
0.391
MAK-UNK-de9577cf-1
0.382
MAK-UNK-148caf23-7
0.378
MAK-UNK-148caf23-5
0.376
MAK-UNK-702fb7d3-3
0.375
MAK-UNK-702fb7d3-1
0.375
MAK-UNK-702fb7d3-2
0.375
MAK-UNK-de9577cf-11
0.374
MAK-UNK-148caf23-6
0.373
MAK-UNK-9a6be56d-31
0.371
MAK-UNK-702fb7d3-17
0.371
MAK-UNK-9a6be56d-24
0.370
MAK-UNK-9a6be56d-26
0.369
MAK-UNK-de9577cf-10
0.368
MAK-UNK-148caf23-23
0.368
MAK-UNK-9a6be56d-25
0.368
MAK-UNK-de9577cf-2
0.367
MAK-UNK-9a6be56d-32
0.364
MAK-UNK-9a6be56d-27
0.364
MAK-UNK-148caf23-4
0.363
MAK-UNK-148caf23-8
0.363
MAK-UNK-148caf23-3
0.363
PEI-IMP-ca0b2813-1
0.362
MAK-UNK-9a6be56d-30
0.362
MAK-UNK-702fb7d3-19
0.361
MAK-UNK-9a6be56d-28
0.359
MAK-UNK-148caf23-2
0.358
MAK-UNK-702fb7d3-18
0.356
MAK-UNK-de9577cf-22
0.353
MAK-UNK-148caf23-14
0.353
MAK-UNK-de9577cf-20
0.351
MAK-UNK-de9577cf-12
0.351