Molecular Properties | |
SMILES: | CNCc1cc(-c2c(F)cccc2CNc2ccc(C#N)cn2)n(S(=O)(=O)c2cccnc2)c1 |
MW: | 476.537 |
Fraction sp3: | 0.12 |
HBA: | 8 |
HBD: | 2 |
Rotatable Bonds: | 8 |
TPSA: | 112.7 |
cLogP: | 3.52438 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
Activated haloaromatics
AAR-POS-d2a4d1df-5
MAK-UNK-148caf23-20
0.689
MAK-UNK-148caf23-21
0.663
MAK-UNK-148caf23-22
0.654
MAK-UNK-148caf23-8
0.540
MAK-UNK-148caf23-11
0.536
MAK-UNK-148caf23-15
0.527
MAK-UNK-148caf23-17
0.527
MAK-UNK-148caf23-18
0.527
MAK-UNK-148caf23-12
0.522
MAK-UNK-148caf23-9
0.518
MAK-UNK-148caf23-7
0.517
MAK-UNK-148caf23-14
0.513
MAK-UNK-148caf23-16
0.509
MAK-UNK-148caf23-10
0.500
MAK-UNK-de9577cf-9
0.487
MAK-UNK-9a6be56d-24
0.479
MAK-UNK-148caf23-19
0.479
MAK-UNK-148caf23-6
0.475
MAK-UNK-148caf23-1
0.471
MAK-UNK-8fdbca50-31
0.449
MAK-UNK-148caf23-4
0.438
MAK-UNK-8fdbca50-15
0.435
MAK-UNK-0955449e-33
0.431
MAK-UNK-148caf23-2
0.431
MAK-UNK-148caf23-5
0.430
MAK-UNK-148caf23-3
0.426
MAK-UNK-0955449e-32
0.423
MAK-UNK-de9577cf-7
0.410
MAK-UNK-de9577cf-8
0.407
MAK-UNK-148caf23-13
0.402
MAK-UNK-0955449e-35
0.402
MAK-UNK-30aad1f1-1
0.400
MAK-UNK-de9577cf-6
0.398
MAK-UNK-0955449e-34
0.394
MAK-UNK-9a6be56d-22
0.392
MAK-UNK-9a6be56d-23
0.392
MAK-UNK-de9577cf-5
0.387
MAK-UNK-9a6be56d-21
0.386
MAK-UNK-de9577cf-4
0.385
MAK-UNK-8fdbca50-30
0.374
MAK-UNK-9a6be56d-6
0.372
MAK-UNK-9a6be56d-2
0.368
MAK-UNK-8fdbca50-27
0.368
MAK-UNK-8fdbca50-28
0.368
MAK-UNK-8fdbca50-13
0.368
MAK-UNK-8fdbca50-14
0.363
MAK-UNK-8fdbca50-11
0.355
MAK-UNK-8fdbca50-26
0.353
MAK-UNK-8fdbca50-12
0.353
MAK-UNK-9a6be56d-27
0.351
MAK-UNK-de9577cf-1
0.346
MAK-UNK-9a6be56d-26
0.346
MAK-UNK-de9577cf-2
0.341
MAK-UNK-9a6be56d-32
0.341
MAK-UNK-8fdbca50-40
0.341
MAK-UNK-30aad1f1-6
0.339
MAK-UNK-9a6be56d-30
0.338
MAK-UNK-de9577cf-13
0.336
MAK-UNK-9a6be56d-10
0.336
MAK-UNK-9a6be56d-28
0.336
MAK-UNK-9a6be56d-25
0.336
ANT-OPE-a517596a-1
0.333
MAK-UNK-de9577cf-10
0.333
MAK-UNK-8fdbca50-33
0.333
MAK-UNK-30aad1f1-4
0.330
MAK-UNK-9a6be56d-29
0.328
MAK-UNK-9a6be56d-31
0.328
MAK-UNK-de9577cf-22
0.328
MAK-UNK-30aad1f1-7
0.327
MAK-UNK-702fb7d3-6
0.326
MAK-UNK-8fdbca50-38
0.326
MAK-UNK-9a6be56d-3
0.326
MAK-UNK-702fb7d3-2
0.324
MAK-UNK-8fdbca50-41
0.324
MAK-UNK-8fdbca50-35
0.321
MAK-UNK-8fdbca50-16
0.321
MAK-UNK-9a6be56d-5
0.321
MAK-UNK-9a6be56d-1
0.321
MAK-UNK-de9577cf-15
0.320
MAK-UNK-702fb7d3-12
0.319
MAK-UNK-702fb7d3-11
0.319
MAK-UNK-de9577cf-11
0.318
MAK-UNK-702fb7d3-8
0.317
MAK-UNK-8fdbca50-34
0.317
MAK-UNK-702fb7d3-4
0.317
MAK-UNK-702fb7d3-10
0.315
MAK-UNK-de9577cf-20
0.315
MAK-UNK-702fb7d3-3
0.315
MAK-UNK-702fb7d3-9
0.315
MAK-UNK-8fdbca50-32
0.314
MAK-UNK-8fdbca50-39
0.314
MAK-UNK-702fb7d3-13
0.313
MAK-UNK-de9577cf-19
0.312
MAK-UNK-702fb7d3-14
0.312
MAK-UNK-702fb7d3-5
0.312
MAK-UNK-de9577cf-17
0.311
MAK-UNK-9a6be56d-14
0.309
MAK-UNK-8fdbca50-1
0.308
MAK-UNK-702fb7d3-7
0.308
MAK-UNK-de9577cf-16
0.306