Molecular Properties | |
SMILES: | CNC(c1cc(-c2ccccc2F)n(S(=O)(=O)c2cccnc2)c1)C(C)N(C)C(=O)C1CCN(C(=O)CCl)CC1 |
MW: | 590.121 |
Fraction sp3: | 0.39 |
HBA: | 7 |
HBD: | 1 |
Rotatable Bonds: | 9 |
TPSA: | 104.61 |
cLogP: | 3.511 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
Activated haloaromatics
Long aliphatic chain
AAR-POS-d2a4d1df-5
MAK-UNK-8fdbca50-18
0.739
MAK-UNK-8fdbca50-2
0.687
MAK-UNK-8fdbca50-1
0.672
MAK-UNK-8fdbca50-32
0.633
MAK-UNK-8fdbca50-16
0.628
MAK-UNK-8fdbca50-17
0.622
MAK-UNK-8fdbca50-39
0.620
MAK-UNK-8fdbca50-41
0.620
MAK-UNK-8fdbca50-40
0.608
MAK-UNK-8fdbca50-14
0.593
MAK-UNK-8fdbca50-5
0.592
MAK-UNK-8fdbca50-34
0.592
MAK-UNK-8fdbca50-13
0.584
MAK-UNK-8fdbca50-33
0.581
MAK-UNK-8fdbca50-12
0.562
MAK-UNK-8fdbca50-37
0.562
MAK-UNK-8fdbca50-30
0.561
MAK-UNK-8fdbca50-38
0.560
MAK-UNK-8fdbca50-20
0.556
MAK-UNK-8fdbca50-7
0.555
MAK-UNK-8fdbca50-11
0.555
MAK-UNK-8fdbca50-9
0.552
MAK-UNK-8fdbca50-28
0.552
MAK-UNK-8fdbca50-8
0.551
MAK-UNK-8fdbca50-36
0.550
MAK-UNK-8fdbca50-23
0.540
MAK-UNK-8fdbca50-27
0.540
MAK-UNK-8fdbca50-35
0.539
MAK-UNK-8fdbca50-15
0.538
MAK-UNK-8fdbca50-6
0.531
MAK-UNK-8fdbca50-22
0.520
MAK-UNK-8fdbca50-26
0.519
MAK-UNK-8fdbca50-31
0.519
MAK-UNK-8fdbca50-24
0.516
MAK-UNK-8fdbca50-21
0.512
MAK-UNK-8fdbca50-10
0.511
MAK-UNK-8fdbca50-4
0.508
MAK-UNK-8fdbca50-25
0.489
MAK-UNK-8fdbca50-19
0.485
MAK-UNK-de9577cf-12
0.476
MAK-UNK-148caf23-10
0.453
MAK-UNK-702fb7d3-6
0.453
MAK-UNK-702fb7d3-5
0.451
MAK-UNK-702fb7d3-13
0.444
MAK-UNK-702fb7d3-12
0.443
MAK-UNK-de9577cf-2
0.439
MAK-UNK-702fb7d3-9
0.439
MAK-UNK-702fb7d3-10
0.437
MAK-UNK-702fb7d3-14
0.436
MAK-UNK-9a6be56d-9
0.433
MAK-UNK-702fb7d3-11
0.433
MAK-UNK-702fb7d3-8
0.430
MAK-UNK-de9577cf-3
0.424
MAK-UNK-702fb7d3-7
0.421
MAK-UNK-de9577cf-1
0.419
MAK-UNK-702fb7d3-1
0.418
MAK-UNK-9a6be56d-31
0.416
MAK-UNK-9a6be56d-3
0.415
MAK-UNK-702fb7d3-21
0.414
MAK-UNK-702fb7d3-17
0.414
MAK-UNK-702fb7d3-4
0.411
MAK-UNK-702fb7d3-18
0.408
MAK-UNK-702fb7d3-2
0.408
MAK-UNK-702fb7d3-19
0.404
MAK-UNK-702fb7d3-20
0.404
MAK-UNK-148caf23-7
0.403
MAK-UNK-de9577cf-11
0.400
MAK-UNK-9a6be56d-4
0.400
MAK-UNK-702fb7d3-3
0.399
MAK-UNK-9a6be56d-32
0.399
MAK-UNK-9a6be56d-30
0.396
MAK-UNK-9a6be56d-29
0.396
MAK-UNK-de9577cf-10
0.394
MAK-UNK-9a6be56d-25
0.392
MAK-UNK-148caf23-5
0.391
MAK-UNK-9a6be56d-1
0.388
MAK-UNK-9a6be56d-8
0.388
MAK-UNK-9a6be56d-27
0.388
MAK-UNK-148caf23-4
0.388
MAK-UNK-148caf23-6
0.388
MAK-UNK-148caf23-8
0.388
MAK-UNK-9a6be56d-26
0.383
MAK-UNK-148caf23-9
0.381
MAK-UNK-148caf23-3
0.378
MAK-UNK-148caf23-1
0.375
MAK-UNK-9a6be56d-28
0.373
MAK-UNK-148caf23-2
0.372
MAK-UNK-de9577cf-22
0.358
MAK-UNK-de9577cf-15
0.351
MAK-UNK-9a6be56d-5
0.350
MAK-UNK-9a6be56d-14
0.347
VIR-GIT-7b3d3065-3
0.343
AAR-POS-0daf6b7e-19
0.343
PEI-IMP-ca0b2813-1
0.343
MAK-UNK-de9577cf-4
0.341
MAK-UNK-148caf23-14
0.338
MAK-UNK-de9577cf-13
0.336
MAK-UNK-9a6be56d-10
0.336
SAD-SAT-29425be4-27
0.333
MAK-UNK-148caf23-12
0.333