Molecular Properties | |
SMILES: | CNCc1cc(-c2ccccc2F)n(S(=O)(=O)c2cccnc2C(C)N(C)C(=O)C2CCN(C(=O)CCl)CC2)c1 |
MW: | 590.121 |
Fraction sp3: | 0.39 |
HBA: | 7 |
HBD: | 1 |
Rotatable Bonds: | 9 |
TPSA: | 104.61 |
cLogP: | 3.6424 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
Activated haloaromatics
AAR-POS-d2a4d1df-5
MAK-UNK-8fdbca50-6
0.703
MAK-UNK-8fdbca50-25
0.698
MAK-UNK-8fdbca50-8
0.672
MAK-UNK-8fdbca50-9
0.661
MAK-UNK-8fdbca50-7
0.648
MAK-UNK-8fdbca50-21
0.642
MAK-UNK-8fdbca50-23
0.608
MAK-UNK-8fdbca50-24
0.597
MAK-UNK-8fdbca50-22
0.585
MAK-UNK-8fdbca50-5
0.583
MAK-UNK-8fdbca50-13
0.562
MAK-UNK-8fdbca50-14
0.559
MAK-UNK-8fdbca50-1
0.558
MAK-UNK-8fdbca50-20
0.547
MAK-UNK-8fdbca50-12
0.542
MAK-UNK-8fdbca50-2
0.531
MAK-UNK-8fdbca50-32
0.523
MAK-UNK-8fdbca50-41
0.523
MAK-UNK-8fdbca50-16
0.519
MAK-UNK-8fdbca50-40
0.512
MAK-UNK-8fdbca50-3
0.511
MAK-UNK-8fdbca50-39
0.511
MAK-UNK-8fdbca50-11
0.511
MAK-UNK-8fdbca50-34
0.511
MAK-UNK-8fdbca50-28
0.508
MAK-UNK-8fdbca50-15
0.507
MAK-UNK-8fdbca50-30
0.504
MAK-UNK-8fdbca50-33
0.489
MAK-UNK-8fdbca50-17
0.489
MAK-UNK-8fdbca50-27
0.485
MAK-UNK-8fdbca50-26
0.467
MAK-UNK-8fdbca50-31
0.467
MAK-UNK-8fdbca50-18
0.466
MAK-UNK-8fdbca50-37
0.464
MAK-UNK-de9577cf-21
0.457
MAK-UNK-8fdbca50-36
0.453
MAK-UNK-8fdbca50-35
0.442
MAK-UNK-8fdbca50-38
0.438
MAK-UNK-8fdbca50-4
0.435
MAK-UNK-9a6be56d-19
0.428
MAK-UNK-148caf23-19
0.427
MAK-UNK-8fdbca50-19
0.423
MAK-UNK-de9577cf-16
0.410
MAK-UNK-148caf23-15
0.391
MAK-UNK-de9577cf-19
0.389
MAK-UNK-9a6be56d-15
0.380
MAK-UNK-de9577cf-20
0.371
MAK-UNK-148caf23-16
0.368
MAK-UNK-9a6be56d-17
0.366
MAK-UNK-702fb7d3-9
0.365
MAK-UNK-702fb7d3-14
0.362
MAK-UNK-702fb7d3-13
0.362
MAK-UNK-148caf23-18
0.360
MAK-UNK-148caf23-17
0.360
MAK-UNK-702fb7d3-11
0.360
MAK-UNK-702fb7d3-12
0.360
MAK-UNK-702fb7d3-6
0.358
MAK-UNK-702fb7d3-8
0.358
MAK-UNK-702fb7d3-10
0.355
MAK-UNK-de9577cf-17
0.355
MAK-UNK-9a6be56d-5
0.354
MAK-UNK-702fb7d3-5
0.354
MAK-UNK-148caf23-14
0.353
MAK-UNK-0955449e-15
0.352
MAK-UNK-9a6be56d-18
0.352
MAK-UNK-9a6be56d-16
0.352
AAR-POS-0daf6b7e-19
0.350
VIR-GIT-7b3d3065-3
0.350
MAK-UNK-702fb7d3-4
0.349
MAK-UNK-702fb7d3-7
0.349
MAK-UNK-148caf23-2
0.338
LON-WEI-120e5cf5-5
0.336
MAK-UNK-de9577cf-22
0.333
MAK-UNK-9a6be56d-14
0.333
MAK-UNK-148caf23-8
0.333
SAD-SAT-9a6c5cf3-10
0.331
MAK-UNK-702fb7d3-3
0.329
MAK-UNK-702fb7d3-1
0.329
MAK-UNK-148caf23-7
0.329
MAK-UNK-de9577cf-2
0.326
MAK-UNK-0955449e-28
0.325
MAK-UNK-0955449e-23
0.325
MAK-UNK-702fb7d3-17
0.325
MAK-UNK-148caf23-4
0.324
MAK-UNK-148caf23-3
0.324
MAK-UNK-148caf23-6
0.324
MAK-UNK-0955449e-19
0.323
MAK-UNK-9a6be56d-26
0.322
MAK-UNK-de9577cf-1
0.321
MAK-UNK-702fb7d3-2
0.320
YOI-UNK-a533afbc-6
0.319
YOI-UNK-12211982-6
0.319
MAK-UNK-0955449e-3
0.318
MAK-UNK-9a6be56d-27
0.318
SAD-SAT-29425be4-16
0.317
MAK-UNK-148caf23-5
0.317
MAK-UNK-148caf23-9
0.317
MAK-UNK-9a6be56d-29
0.315
MAK-UNK-9a6be56d-30
0.315
MAK-UNK-9a6be56d-31
0.315