Molecular Properties | |
SMILES: | CC(C)N(C)C(=O)C1(NCc2cc(-c3ccccc3F)n(S(=O)(=O)c3cccnc3)c2)CCN(C(=O)CCl)CC1 |
MW: | 590.121 |
Fraction sp3: | 0.39 |
HBA: | 7 |
HBD: | 1 |
Rotatable Bonds: | 9 |
TPSA: | 104.61 |
cLogP: | 3.4826 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
Activated haloaromatics
Long aliphatic chain
AAR-POS-d2a4d1df-5
MAK-UNK-8fdbca50-35
0.661
MAK-UNK-8fdbca50-39
0.639
MAK-UNK-8fdbca50-2
0.622
MAK-UNK-8fdbca50-1
0.610
MAK-UNK-8fdbca50-37
0.605
MAK-UNK-8fdbca50-40
0.600
MAK-UNK-8fdbca50-16
0.593
MAK-UNK-8fdbca50-17
0.587
MAK-UNK-8fdbca50-41
0.585
MAK-UNK-8fdbca50-32
0.585
MAK-UNK-8fdbca50-36
0.579
MAK-UNK-8fdbca50-34
0.571
MAK-UNK-702fb7d3-6
0.571
MAK-UNK-8fdbca50-3
0.560
MAK-UNK-8fdbca50-33
0.560
MAK-UNK-702fb7d3-4
0.547
MAK-UNK-8fdbca50-18
0.524
MAK-UNK-702fb7d3-5
0.524
MAK-UNK-702fb7d3-11
0.511
MAK-UNK-8fdbca50-28
0.508
MAK-UNK-8fdbca50-8
0.508
MAK-UNK-8fdbca50-12
0.508
MAK-UNK-702fb7d3-9
0.508
MAK-UNK-de9577cf-2
0.504
MAK-UNK-8fdbca50-30
0.504
MAK-UNK-8fdbca50-13
0.504
MAK-UNK-702fb7d3-14
0.504
MAK-UNK-9a6be56d-32
0.500
MAK-UNK-8fdbca50-5
0.500
MAK-UNK-8fdbca50-22
0.500
MAK-UNK-8fdbca50-14
0.500
MAK-UNK-702fb7d3-12
0.500
MAK-UNK-702fb7d3-8
0.496
MAK-UNK-8fdbca50-23
0.496
MAK-UNK-702fb7d3-10
0.493
MAK-UNK-de9577cf-1
0.492
MAK-UNK-702fb7d3-13
0.489
MAK-UNK-702fb7d3-7
0.489
MAK-UNK-8fdbca50-7
0.489
MAK-UNK-702fb7d3-1
0.485
MAK-UNK-8fdbca50-27
0.485
MAK-UNK-148caf23-7
0.484
MAK-UNK-148caf23-8
0.480
MAK-UNK-8fdbca50-11
0.478
MAK-UNK-8fdbca50-20
0.477
MAK-UNK-de9577cf-10
0.476
MAK-UNK-702fb7d3-2
0.474
MAK-UNK-8fdbca50-9
0.473
MAK-UNK-148caf23-2
0.472
MAK-UNK-8fdbca50-24
0.472
MAK-UNK-de9577cf-11
0.472
MAK-UNK-148caf23-6
0.468
MAK-UNK-8fdbca50-26
0.466
MAK-UNK-148caf23-1
0.465
MAK-UNK-702fb7d3-3
0.463
MAK-UNK-9a6be56d-31
0.462
MAK-UNK-148caf23-5
0.460
MAK-UNK-148caf23-9
0.460
MAK-UNK-702fb7d3-17
0.459
MAK-UNK-148caf23-4
0.457
MAK-UNK-148caf23-3
0.457
MAK-UNK-8fdbca50-6
0.456
MAK-UNK-9a6be56d-27
0.455
MAK-UNK-9a6be56d-29
0.451
MAK-UNK-9a6be56d-3
0.450
MAK-UNK-9a6be56d-26
0.448
MAK-UNK-9a6be56d-28
0.448
MAK-UNK-8fdbca50-21
0.448
MAK-UNK-9a6be56d-25
0.445
MAK-UNK-8fdbca50-31
0.444
MAK-UNK-9a6be56d-1
0.444
MAK-UNK-8fdbca50-15
0.442
MAK-UNK-702fb7d3-18
0.442
MAK-UNK-9a6be56d-30
0.440
MAK-UNK-702fb7d3-19
0.438
MAK-UNK-8fdbca50-10
0.438
MAK-UNK-8fdbca50-25
0.437
MAK-UNK-9a6be56d-8
0.433
MAK-UNK-de9577cf-3
0.416
MAK-UNK-702fb7d3-20
0.407
MAK-UNK-702fb7d3-21
0.407
MAK-UNK-de9577cf-7
0.397
MAK-UNK-de9577cf-17
0.394
MAK-UNK-8fdbca50-4
0.393
MAK-UNK-8fdbca50-19
0.391
MAK-UNK-de9577cf-12
0.389
MAK-UNK-de9577cf-19
0.388
MAK-UNK-148caf23-16
0.386
MAK-UNK-0955449e-32
0.385
MAK-UNK-de9577cf-4
0.385
MAK-UNK-9a6be56d-4
0.382
MAK-UNK-148caf23-10
0.381
MAK-UNK-de9577cf-22
0.381
MAK-UNK-de9577cf-5
0.376
MAK-UNK-de9577cf-6
0.376
MAK-UNK-de9577cf-8
0.373
MAK-UNK-148caf23-21
0.373
MAK-UNK-0955449e-34
0.372
MAK-UNK-148caf23-14
0.370
MAK-UNK-de9577cf-20
0.369