Molecular Properties | |
SMILES: | CC(C)N(CNCc1cc(-c2ccccc2F)n(S(=O)(=O)c2cccnc2)c1)C(=O)C1CCN(C(=O)CCl)CC1 |
MW: | 590.121 |
Fraction sp3: | 0.39 |
HBA: | 7 |
HBD: | 1 |
Rotatable Bonds: | 10 |
TPSA: | 104.61 |
cLogP: | 3.6877 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
non_ring_CH2O_acetal
het-C-het not in ring
Activated haloaromatics
acyclic N-C-N
AAR-POS-d2a4d1df-5
MAK-UNK-8fdbca50-1
0.754
MAK-UNK-8fdbca50-41
0.698
MAK-UNK-8fdbca50-32
0.698
MAK-UNK-8fdbca50-17
0.687
MAK-UNK-8fdbca50-40
0.687
MAK-UNK-8fdbca50-39
0.684
MAK-UNK-8fdbca50-2
0.681
MAK-UNK-8fdbca50-37
0.648
MAK-UNK-8fdbca50-34
0.639
MAK-UNK-8fdbca50-18
0.630
MAK-UNK-8fdbca50-3
0.628
MAK-UNK-8fdbca50-26
0.628
MAK-UNK-8fdbca50-28
0.625
MAK-UNK-8fdbca50-36
0.621
MAK-UNK-8fdbca50-33
0.615
MAK-UNK-8fdbca50-30
0.608
MAK-UNK-8fdbca50-14
0.602
MAK-UNK-8fdbca50-23
0.600
MAK-UNK-8fdbca50-27
0.598
MAK-UNK-8fdbca50-38
0.593
MAK-UNK-8fdbca50-13
0.592
MAK-UNK-8fdbca50-22
0.590
MAK-UNK-8fdbca50-20
0.589
MAK-UNK-8fdbca50-8
0.584
MAK-UNK-8fdbca50-12
0.583
MAK-UNK-8fdbca50-24
0.575
MAK-UNK-8fdbca50-5
0.575
MAK-UNK-8fdbca50-35
0.571
MAK-UNK-8fdbca50-21
0.568
MAK-UNK-8fdbca50-7
0.562
MAK-UNK-8fdbca50-11
0.562
MAK-UNK-8fdbca50-9
0.560
MAK-UNK-8fdbca50-31
0.551
MAK-UNK-8fdbca50-6
0.538
MAK-UNK-8fdbca50-25
0.531
MAK-UNK-702fb7d3-5
0.528
MAK-UNK-8fdbca50-15
0.523
MAK-UNK-702fb7d3-9
0.523
MAK-UNK-8fdbca50-10
0.519
MAK-UNK-de9577cf-10
0.516
MAK-UNK-702fb7d3-11
0.515
MAK-UNK-702fb7d3-13
0.515
MAK-UNK-702fb7d3-1
0.511
MAK-UNK-702fb7d3-14
0.507
MAK-UNK-702fb7d3-10
0.507
MAK-UNK-702fb7d3-6
0.504
MAK-UNK-702fb7d3-7
0.504
MAK-UNK-702fb7d3-12
0.504
MAK-UNK-702fb7d3-8
0.500
MAK-UNK-148caf23-8
0.496
MAK-UNK-de9577cf-1
0.484
MAK-UNK-702fb7d3-4
0.481
MAK-UNK-8fdbca50-19
0.481
MAK-UNK-702fb7d3-3
0.478
MAK-UNK-9a6be56d-29
0.477
MAK-UNK-9a6be56d-31
0.477
MAK-UNK-de9577cf-2
0.471
MAK-UNK-9a6be56d-1
0.470
MAK-UNK-702fb7d3-2
0.467
MAK-UNK-148caf23-7
0.465
MAK-UNK-148caf23-6
0.461
MAK-UNK-148caf23-4
0.461
MAK-UNK-8fdbca50-4
0.459
MAK-UNK-9a6be56d-32
0.459
MAK-UNK-9a6be56d-30
0.455
MAK-UNK-148caf23-5
0.453
MAK-UNK-702fb7d3-17
0.453
MAK-UNK-702fb7d3-19
0.453
MAK-UNK-de9577cf-11
0.452
MAK-UNK-9a6be56d-26
0.452
MAK-UNK-148caf23-3
0.450
MAK-UNK-9a6be56d-27
0.448
MAK-UNK-148caf23-1
0.446
MAK-UNK-148caf23-2
0.443
MAK-UNK-9a6be56d-28
0.441
MAK-UNK-9a6be56d-25
0.439
MAK-UNK-702fb7d3-18
0.436
MAK-UNK-148caf23-9
0.431
MAK-UNK-9a6be56d-8
0.426
MAK-UNK-9a6be56d-3
0.422
MAK-UNK-702fb7d3-21
0.421
MAK-UNK-702fb7d3-20
0.411
MAK-UNK-de9577cf-3
0.409
MAK-UNK-de9577cf-12
0.394
MAK-UNK-de9577cf-7
0.391
MAK-UNK-0955449e-34
0.387
MAK-UNK-de9577cf-19
0.382
MAK-UNK-de9577cf-4
0.379
MAK-UNK-de9577cf-8
0.378
MAK-UNK-9a6be56d-4
0.377
MAK-UNK-de9577cf-22
0.375
MAK-UNK-de9577cf-20
0.374
MAK-UNK-de9577cf-6
0.370
MAK-UNK-0955449e-32
0.368
MAK-UNK-de9577cf-17
0.368
MAK-UNK-9a6be56d-5
0.366
MAK-UNK-0955449e-35
0.366
MAK-UNK-148caf23-10
0.365
MAK-UNK-9a6be56d-14
0.364
MAK-UNK-de9577cf-5
0.360