Molecular Properties | |
SMILES: | CNC(OC(=O)c1ccc(S(N)(=O)=O)cc1)c1cc(-c2ccccc2F)n(S(=O)(=O)c2cccnc2)c1 |
MW: | 544.586 |
Fraction sp3: | 0.08 |
HBA: | 9 |
HBD: | 2 |
Rotatable Bonds: | 8 |
TPSA: | 150.45 |
cLogP: | 2.6486 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
non_ring_acetal
het-C-het not in ring
Activated haloaromatics
Ester
MAT-POS-7dfc56d9-1
MAK-UNK-de9577cf-11
0.641
MAK-UNK-de9577cf-10
0.569
MAK-UNK-9a6be56d-9
0.530
MAK-UNK-de9577cf-3
0.528
MAK-UNK-de9577cf-2
0.519
MAK-UNK-de9577cf-13
0.518
MAK-UNK-148caf23-10
0.518
MAK-UNK-de9577cf-15
0.514
MAK-UNK-de9577cf-1
0.504
MAK-UNK-de9577cf-22
0.504
MAK-UNK-8fdbca50-18
0.500
MAK-UNK-de9577cf-7
0.487
MAK-UNK-8fdbca50-3
0.476
MAK-UNK-de9577cf-6
0.474
MAK-UNK-de9577cf-8
0.470
MAK-UNK-de9577cf-19
0.465
MAK-UNK-9a6be56d-32
0.463
MAK-UNK-de9577cf-5
0.462
MAK-UNK-de9577cf-17
0.458
MAK-UNK-de9577cf-20
0.456
MAK-UNK-de9577cf-9
0.454
MAK-UNK-de9577cf-16
0.450
MAK-UNK-9a6be56d-8
0.440
MAK-UNK-9a6be56d-31
0.437
MAK-UNK-de9577cf-21
0.430
MAK-UNK-9a6be56d-30
0.425
MAK-UNK-8fdbca50-40
0.417
MAK-UNK-9a6be56d-1
0.417
MAK-UNK-9a6be56d-29
0.414
MAK-UNK-de9577cf-4
0.412
MAK-UNK-148caf23-7
0.411
MAK-UNK-9a6be56d-28
0.411
MAK-UNK-148caf23-9
0.410
MAK-UNK-9a6be56d-25
0.409
MAK-UNK-9a6be56d-4
0.408
MAK-UNK-8fdbca50-33
0.408
MAK-UNK-8fdbca50-39
0.408
MAK-UNK-9a6be56d-27
0.406
MAK-UNK-de9577cf-14
0.402
MAK-UNK-9a6be56d-3
0.402
MAK-UNK-9a6be56d-26
0.400
MAK-UNK-8fdbca50-1
0.398
MAK-UNK-8fdbca50-32
0.397
MAK-UNK-8fdbca50-41
0.397
MAK-UNK-8fdbca50-36
0.396
MAK-UNK-8fdbca50-17
0.395
MAK-UNK-148caf23-3
0.395
MAK-UNK-148caf23-6
0.395
MAK-UNK-8fdbca50-16
0.394
MAK-UNK-8fdbca50-35
0.394
MAK-UNK-8fdbca50-2
0.392
MAK-UNK-148caf23-1
0.392
MAK-UNK-702fb7d3-20
0.391
MAK-UNK-702fb7d3-21
0.391
MAK-UNK-8fdbca50-38
0.389
MAK-UNK-148caf23-2
0.389
MAK-UNK-8fdbca50-34
0.388
MAK-UNK-148caf23-5
0.387
MAK-UNK-8fdbca50-37
0.385
MAK-UNK-148caf23-4
0.384
MAK-UNK-702fb7d3-2
0.375
MAK-UNK-702fb7d3-5
0.374
MAK-UNK-148caf23-8
0.373
MAK-UNK-9a6be56d-10
0.369
MAK-UNK-702fb7d3-6
0.368
MAK-UNK-702fb7d3-7
0.368
MAK-UNK-702fb7d3-18
0.365
MAK-UNK-9a6be56d-14
0.361
MAK-UNK-702fb7d3-17
0.360
MAK-UNK-702fb7d3-12
0.360
MAK-UNK-9a6be56d-12
0.359
MAK-UNK-702fb7d3-4
0.358
MAK-UNK-702fb7d3-8
0.357
MAK-UNK-702fb7d3-1
0.355
MAK-UNK-702fb7d3-9
0.355
MAK-UNK-702fb7d3-10
0.355
MAK-UNK-9a6be56d-22
0.353
MAK-UNK-702fb7d3-14
0.353
MAK-UNK-8fdbca50-28
0.351
MAK-UNK-8fdbca50-27
0.351
MAK-UNK-702fb7d3-19
0.350
MAK-UNK-702fb7d3-11
0.350
MAK-UNK-702fb7d3-3
0.345
MAK-UNK-9a6be56d-23
0.343
MAK-UNK-702fb7d3-13
0.343
MAK-UNK-9a6be56d-21
0.338
MAK-UNK-8fdbca50-30
0.336
MAK-UNK-8fdbca50-20
0.336
MAK-UNK-9a6be56d-6
0.333
MAK-UNK-8fdbca50-13
0.331
MAK-UNK-9a6be56d-2
0.331
MAK-UNK-148caf23-14
0.331
MAK-UNK-8fdbca50-5
0.329
MAK-UNK-9a6be56d-24
0.328
MAK-UNK-8fdbca50-23
0.328
MAK-UNK-8fdbca50-31
0.326
MAK-UNK-8fdbca50-14
0.326
MAK-UNK-9a6be56d-17
0.326
MAK-UNK-148caf23-12
0.326
MAK-UNK-9a6be56d-5
0.324