Molecular Properties | |
SMILES: | CC(C)N(C)C(=O)C1CCN(C(=O)CCl)C(NCc2cc(-c3ccccc3F)n(S(=O)(=O)c3cccnc3)c2)C1 |
MW: | 590.121 |
Fraction sp3: | 0.39 |
HBA: | 7 |
HBD: | 1 |
Rotatable Bonds: | 9 |
TPSA: | 104.61 |
cLogP: | 3.6861 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
Activated haloaromatics
AAR-POS-d2a4d1df-5
MAK-UNK-8fdbca50-37
0.672
MAK-UNK-8fdbca50-32
0.653
MAK-UNK-8fdbca50-34
0.637
MAK-UNK-8fdbca50-35
0.634
MAK-UNK-8fdbca50-39
0.626
MAK-UNK-8fdbca50-33
0.626
MAK-UNK-8fdbca50-1
0.624
MAK-UNK-8fdbca50-16
0.621
MAK-UNK-8fdbca50-2
0.610
MAK-UNK-8fdbca50-40
0.589
MAK-UNK-8fdbca50-41
0.587
MAK-UNK-8fdbca50-38
0.579
MAK-UNK-8fdbca50-17
0.563
MAK-UNK-702fb7d3-5
0.563
MAK-UNK-702fb7d3-7
0.562
MAK-UNK-8fdbca50-3
0.550
MAK-UNK-8fdbca50-18
0.539
MAK-UNK-9a6be56d-31
0.535
MAK-UNK-8fdbca50-13
0.519
MAK-UNK-8fdbca50-14
0.515
MAK-UNK-8fdbca50-28
0.511
MAK-UNK-8fdbca50-30
0.508
MAK-UNK-702fb7d3-14
0.507
MAK-UNK-8fdbca50-5
0.504
MAK-UNK-702fb7d3-12
0.504
MAK-UNK-8fdbca50-23
0.500
MAK-UNK-9a6be56d-29
0.500
MAK-UNK-8fdbca50-8
0.500
MAK-UNK-8fdbca50-12
0.500
MAK-UNK-de9577cf-1
0.496
MAK-UNK-de9577cf-2
0.496
MAK-UNK-702fb7d3-13
0.493
MAK-UNK-8fdbca50-7
0.493
MAK-UNK-8fdbca50-11
0.493
MAK-UNK-702fb7d3-8
0.489
MAK-UNK-702fb7d3-9
0.489
MAK-UNK-9a6be56d-30
0.489
MAK-UNK-8fdbca50-9
0.489
MAK-UNK-8fdbca50-27
0.489
MAK-UNK-702fb7d3-6
0.482
MAK-UNK-8fdbca50-20
0.481
MAK-UNK-8fdbca50-26
0.481
MAK-UNK-8fdbca50-22
0.481
MAK-UNK-702fb7d3-10
0.475
MAK-UNK-702fb7d3-11
0.471
MAK-UNK-702fb7d3-4
0.471
MAK-UNK-8fdbca50-6
0.471
MAK-UNK-de9577cf-10
0.469
MAK-UNK-702fb7d3-1
0.468
MAK-UNK-702fb7d3-2
0.468
MAK-UNK-148caf23-7
0.466
MAK-UNK-8fdbca50-24
0.466
MAK-UNK-702fb7d3-3
0.457
MAK-UNK-8fdbca50-15
0.457
MAK-UNK-148caf23-5
0.454
MAK-UNK-8fdbca50-10
0.453
MAK-UNK-702fb7d3-17
0.453
MAK-UNK-de9577cf-11
0.453
MAK-UNK-8fdbca50-21
0.453
MAK-UNK-148caf23-3
0.450
MAK-UNK-148caf23-4
0.450
MAK-UNK-148caf23-6
0.450
MAK-UNK-148caf23-8
0.450
MAK-UNK-8fdbca50-31
0.449
MAK-UNK-148caf23-2
0.444
MAK-UNK-9a6be56d-26
0.442
MAK-UNK-9a6be56d-28
0.442
MAK-UNK-9a6be56d-1
0.438
MAK-UNK-9a6be56d-8
0.438
MAK-UNK-9a6be56d-27
0.438
MAK-UNK-148caf23-1
0.436
MAK-UNK-9a6be56d-3
0.434
MAK-UNK-702fb7d3-19
0.433
MAK-UNK-8fdbca50-25
0.432
MAK-UNK-9a6be56d-25
0.430
MAK-UNK-9a6be56d-32
0.428
MAK-UNK-702fb7d3-18
0.427
MAK-UNK-de9577cf-3
0.422
MAK-UNK-148caf23-9
0.421
MAK-UNK-702fb7d3-21
0.413
MAK-UNK-702fb7d3-20
0.403
MAK-UNK-8fdbca50-4
0.399
MAK-UNK-de9577cf-12
0.396
THO-SYG-f9b2970d-7
0.392
MAK-UNK-de9577cf-4
0.391
MAK-UNK-8fdbca50-19
0.387
MAK-UNK-de9577cf-7
0.382
MAK-UNK-9a6be56d-4
0.379
MAK-UNK-de9577cf-22
0.377
THO-SYG-f9b2970d-5
0.375
MAK-UNK-de9577cf-19
0.373
MAK-UNK-de9577cf-6
0.372
MAK-UNK-9a6be56d-9
0.371
MAK-UNK-de9577cf-8
0.370
MAK-UNK-de9577cf-17
0.370
MAK-UNK-0955449e-34
0.369
MAK-UNK-de9577cf-20
0.366
MAK-UNK-9a6be56d-14
0.366
MAK-UNK-de9577cf-5
0.362
MAK-UNK-0955449e-32
0.359