Molecular Properties | |
SMILES: | CNCc1cc(-c2ccccc2F)n(S(=O)(=O)c2ccc(N(C(=O)C3CCN(C(=O)CCl)CC3)C(C)C)nc2)c1 |
MW: | 590.121 |
Fraction sp3: | 0.39 |
HBA: | 7 |
HBD: | 1 |
Rotatable Bonds: | 9 |
TPSA: | 104.61 |
cLogP: | 3.8644 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
Activated haloaromatics
AAR-POS-d2a4d1df-5
MAK-UNK-8fdbca50-8
0.745
MAK-UNK-8fdbca50-24
0.726
MAK-UNK-8fdbca50-22
0.725
MAK-UNK-8fdbca50-25
0.667
MAK-UNK-8fdbca50-21
0.667
MAK-UNK-8fdbca50-7
0.644
MAK-UNK-8fdbca50-9
0.643
MAK-UNK-8fdbca50-28
0.629
MAK-UNK-8fdbca50-30
0.612
MAK-UNK-8fdbca50-10
0.608
MAK-UNK-8fdbca50-6
0.603
MAK-UNK-8fdbca50-27
0.602
MAK-UNK-8fdbca50-16
0.600
MAK-UNK-8fdbca50-20
0.592
MAK-UNK-8fdbca50-1
0.590
MAK-UNK-8fdbca50-40
0.580
MAK-UNK-8fdbca50-41
0.579
MAK-UNK-8fdbca50-17
0.567
MAK-UNK-8fdbca50-39
0.566
MAK-UNK-8fdbca50-5
0.565
MAK-UNK-8fdbca50-2
0.562
MAK-UNK-8fdbca50-13
0.556
MAK-UNK-8fdbca50-31
0.553
MAK-UNK-8fdbca50-14
0.553
MAK-UNK-8fdbca50-32
0.540
MAK-UNK-8fdbca50-3
0.540
MAK-UNK-8fdbca50-26
0.540
MAK-UNK-8fdbca50-12
0.535
MAK-UNK-8fdbca50-18
0.528
MAK-UNK-8fdbca50-11
0.528
MAK-UNK-8fdbca50-37
0.523
MAK-UNK-8fdbca50-34
0.516
MAK-UNK-de9577cf-19
0.509
MAK-UNK-8fdbca50-33
0.504
MAK-UNK-8fdbca50-36
0.500
MAK-UNK-8fdbca50-38
0.496
MAK-UNK-9a6be56d-17
0.496
MAK-UNK-8fdbca50-15
0.489
MAK-UNK-148caf23-17
0.483
MAK-UNK-8fdbca50-35
0.477
MAK-UNK-de9577cf-20
0.450
MAK-UNK-de9577cf-17
0.440
MAK-UNK-8fdbca50-19
0.435
MAK-UNK-702fb7d3-6
0.426
MAK-UNK-de9577cf-21
0.425
MAK-UNK-702fb7d3-8
0.424
MAK-UNK-702fb7d3-5
0.424
MAK-UNK-702fb7d3-9
0.423
MAK-UNK-9a6be56d-16
0.421
MAK-UNK-148caf23-16
0.421
MAK-UNK-702fb7d3-13
0.418
MAK-UNK-702fb7d3-11
0.417
MAK-UNK-8fdbca50-4
0.415
MAK-UNK-148caf23-18
0.413
MAK-UNK-9a6be56d-18
0.412
MAK-UNK-702fb7d3-10
0.411
MAK-UNK-de9577cf-16
0.411
MAK-UNK-702fb7d3-14
0.410
MAK-UNK-702fb7d3-12
0.407
MAK-UNK-702fb7d3-7
0.406
MAK-UNK-702fb7d3-4
0.406
MAK-UNK-de9577cf-1
0.402
MAK-UNK-9a6be56d-15
0.400
MAK-UNK-9a6be56d-29
0.400
MAK-UNK-9a6be56d-19
0.397
MAK-UNK-9a6be56d-31
0.390
MAK-UNK-148caf23-7
0.386
MAK-UNK-0955449e-15
0.386
MAK-UNK-148caf23-19
0.385
MAK-UNK-702fb7d3-1
0.383
MAK-UNK-702fb7d3-2
0.383
MAK-UNK-702fb7d3-3
0.383
MAK-UNK-148caf23-6
0.382
MAK-UNK-148caf23-8
0.382
MAK-UNK-148caf23-15
0.380
MAK-UNK-9a6be56d-30
0.380
MAK-UNK-de9577cf-10
0.377
MAK-UNK-de9577cf-2
0.376
MAK-UNK-9a6be56d-25
0.376
MAK-UNK-9a6be56d-32
0.372
MAK-UNK-9a6be56d-1
0.372
MAK-UNK-de9577cf-11
0.372
MAK-UNK-148caf23-4
0.371
MAK-UNK-de9577cf-22
0.371
MAK-UNK-9a6be56d-14
0.370
MAK-UNK-702fb7d3-17
0.369
MAK-UNK-702fb7d3-19
0.369
MAK-UNK-9a6be56d-26
0.367
MAK-UNK-148caf23-2
0.366
MAK-UNK-de9577cf-4
0.364
MAK-UNK-148caf23-5
0.364
MAK-UNK-702fb7d3-18
0.364
MAK-UNK-9a6be56d-5
0.362
MAK-UNK-9a6be56d-27
0.362
MAK-UNK-148caf23-3
0.361
MAK-UNK-148caf23-14
0.361
MAK-UNK-148caf23-1
0.358
MAK-UNK-9a6be56d-3
0.358
MAK-UNK-de9577cf-6
0.356
MAK-UNK-de9577cf-7
0.356