Molecular Properties | |
SMILES: | CNCc1cc(-c2ccccc2F)n(C(CCNC(=O)OC)c2cccnc2)c1 |
MW: | 396.466 |
Fraction sp3: | 0.27 |
HBA: | 5 |
HBD: | 2 |
Rotatable Bonds: | 8 |
TPSA: | 68.18 |
cLogP: | 3.7441 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✔️ |
carbamate include di-substitued N
Long aliphatic chain
MAK-UNK-0955449e-5
0.626
MAK-UNK-0955449e-3
0.579
MAK-UNK-0955449e-22
0.474
MAK-UNK-0955449e-12
0.462
MAK-UNK-0955449e-14
0.447
MAK-UNK-0955449e-16
0.447
MAK-UNK-0955449e-7
0.444
MAK-UNK-0955449e-2
0.429
MAK-UNK-de9577cf-22
0.388
MAK-UNK-0955449e-6
0.376
MAK-UNK-8fdbca50-20
0.369
MAK-UNK-0955449e-11
0.366
MAK-UNK-0955449e-23
0.365
MAK-UNK-0955449e-28
0.364
MAK-UNK-8fdbca50-5
0.361
MAK-UNK-0955449e-24
0.358
MAK-UNK-0955449e-25
0.358
MAK-UNK-0955449e-13
0.357
MAK-UNK-148caf23-14
0.355
MAK-UNK-0955449e-8
0.353
MAK-UNK-de9577cf-16
0.352
MAK-UNK-8fdbca50-21
0.351
MAK-UNK-de9577cf-2
0.347
MAK-UNK-8fdbca50-35
0.346
MAK-UNK-0955449e-19
0.345
MAK-UNK-0955449e-26
0.343
MAK-UNK-0955449e-15
0.343
MAK-UNK-de9577cf-1
0.341
MAK-UNK-702fb7d3-4
0.341
MAK-UNK-0955449e-17
0.339
MAK-UNK-0955449e-20
0.337
MAK-UNK-de9577cf-17
0.336
MAK-UNK-8fdbca50-7
0.331
MAK-UNK-8fdbca50-6
0.331
MAK-UNK-8fdbca50-25
0.331
MAK-UNK-8fdbca50-38
0.331
MAK-UNK-8fdbca50-23
0.331
MAK-UNK-0955449e-27
0.331
MAK-UNK-8fdbca50-3
0.328
MAK-UNK-de9577cf-19
0.328
MAK-UNK-0955449e-10
0.327
MAK-UNK-8fdbca50-22
0.326
MAK-UNK-9a6be56d-5
0.326
MAK-UNK-702fb7d3-5
0.326
MAK-UNK-de9577cf-15
0.325
MAK-UNK-702fb7d3-17
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MAK-UNK-9a6be56d-14
0.323
MAK-UNK-de9577cf-21
0.323
MAK-UNK-de9577cf-11
0.323
MAK-UNK-702fb7d3-6
0.321
MAK-UNK-8fdbca50-1
0.321
MAK-UNK-148caf23-15
0.320
MAK-UNK-de9577cf-20
0.320
MAK-UNK-8fdbca50-37
0.319
MAK-UNK-8fdbca50-32
0.319
MAK-UNK-8fdbca50-41
0.319
MAK-UNK-de9577cf-10
0.317
MAK-UNK-0955449e-21
0.317
MAK-UNK-8fdbca50-8
0.316
MAK-UNK-8fdbca50-16
0.316
MAK-UNK-8fdbca50-40
0.316
MAK-UNK-8fdbca50-18
0.316
MAK-UNK-148caf23-19
0.315
MAK-UNK-702fb7d3-11
0.314
MAK-UNK-8fdbca50-10
0.314
MAK-UNK-0955449e-9
0.314
MAK-UNK-8fdbca50-9
0.313
MAK-UNK-8fdbca50-2
0.313
MAK-UNK-148caf23-3
0.312
MAK-UNK-148caf23-4
0.312
MAK-UNK-148caf23-6
0.312
MAK-UNK-8fdbca50-34
0.312
MAK-UNK-de9577cf-3
0.311
MAK-UNK-de9577cf-12
0.310
MAK-UNK-702fb7d3-2
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MAK-UNK-702fb7d3-1
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MAK-UNK-702fb7d3-3
0.309
MAK-UNK-8fdbca50-39
0.309
MAK-UNK-8fdbca50-33
0.309
MAK-UNK-148caf23-2
0.308
MAK-UNK-8fdbca50-24
0.308
MAK-UNK-148caf23-7
0.308
MAK-UNK-8fdbca50-17
0.306
MAK-UNK-148caf23-5
0.305
MAK-UNK-702fb7d3-20
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MAK-UNK-9a6be56d-29
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MAK-UNK-8fdbca50-28
0.304
MAK-UNK-0955449e-29
0.303
MAK-UNK-148caf23-8
0.302
MAK-UNK-702fb7d3-7
0.302
MAK-UNK-8fdbca50-36
0.300
MAK-UNK-702fb7d3-9
0.300
MAK-UNK-702fb7d3-13
0.299
MAK-UNK-8fdbca50-30
0.299
MAK-UNK-702fb7d3-14
0.298
MAK-UNK-de9577cf-7
0.297
MAK-UNK-148caf23-16
0.297
MAK-UNK-9a6be56d-32
0.296
MAK-UNK-8fdbca50-19
0.296
MAK-UNK-702fb7d3-12
0.296