Molecular Properties | |
SMILES: | CN(c1cccc(C(=O)Nc2cccc(N3CCCC3=O)c2)c1)S(C)(=O)=O |
MW: | 387.13 |
Fraction sp3: | 0.26 |
HBA: | 4 |
HBD: | 1 |
Rotatable Bonds: | 5 |
TPSA: | 86.79 |
cLogP: | 2.46 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✔️ |
Hetero_hetero
LON-WEI-8f408cad-1
MAK-UNK-9159f8ed-6
0.658
MAK-UNK-1e8f9e3c-1
0.658
MAK-UNK-10dfa458-25
0.588
MAK-UNK-1e8f9e3c-3
0.585
MAK-UNK-6435e6c2-4
0.542
MAK-UNK-c8c8f7e2-16
0.533
MAK-UNK-c8c8f7e2-17
0.532
MAK-UNK-7a704a63-8
0.514
MAK-UNK-c8c8f7e2-15
0.514
MAK-UNK-1e8f9e3c-5
0.512
MAK-UNK-7a704a63-9
0.506
MAK-UNK-c8c8f7e2-18
0.487
MAK-UNK-10dfa458-22
0.487
LON-WEI-8f408cad-1
0.487
MAK-UNK-10dfa458-3
0.487
MAK-UNK-7a704a63-10
0.487
AAR-POS-0daf6b7e-11
0.487
MAK-UNK-9159f8ed-2
0.473
MAK-UNK-9159f8ed-5
0.473
MAK-UNK-1e8f9e3c-4
0.473
MAK-UNK-9159f8ed-4
0.454
MAK-UNK-7a704a63-11
0.449
MAK-UNK-c8c8f7e2-2
0.449
MAK-UNK-9159f8ed-3
0.444
MAK-UNK-9159f8ed-1
0.443
MAK-UNK-c8c8f7e2-4
0.430
MAK-UNK-c8c8f7e2-5
0.422
MAK-UNK-10dfa458-32
0.408
MAK-UNK-902cc841-3
0.406
AAR-UNI-c25c2f1e-103
0.404
MAK-UNK-c8c8f7e2-20
0.400
MAK-UNK-9159f8ed-7
0.400
MAR-TRE-a9136c7b-57
0.396
MAK-UNK-902cc841-4
0.394
MAK-UNK-c8c8f7e2-30
0.383
MAK-UNK-c8c8f7e2-3
0.378
AAR-UNI-c25c2f1e-61
0.378
BAR-COM-0f94fc3d-53
0.374
MAR-TRE-2fd8122f-39
0.372
MAK-UNK-c8c8f7e2-8
0.372
MAK-UNK-c8c8f7e2-1
0.366
MAK-UNK-c8c8f7e2-34
0.357
MAK-UNK-10dfa458-23
0.356
MAK-UNK-c8c8f7e2-6
0.345
MAR-TRE-a9136c7b-42
0.344
MAK-UNK-c8c8f7e2-33
0.341
BAR-COM-4e090d3a-60
0.340
MAR-TRE-799db12b-49
0.337
MAK-UNK-c8c8f7e2-14
0.333
MAK-UNK-7a704a63-2
0.333
MAK-UNK-7a704a63-20
0.333
MAK-UNK-1e8f9e3c-6
0.333
MAR-TRE-799db12b-69
0.330
MAK-UNK-c8c8f7e2-43
0.329
MAK-UNK-7a704a63-3
0.329
MAK-UNK-c8c8f7e2-41
0.329
MAK-UNK-7a704a63-6
0.329
MAK-UNK-7a704a63-18
0.329
MAK-UNK-c8c8f7e2-13
0.329
MAK-UNK-c8c8f7e2-11
0.329
MAK-UNK-c8c8f7e2-32
0.326
MAK-UNK-c8c8f7e2-25
0.326
MAR-TRE-67513f76-4
0.326
MAK-UNK-7a704a63-7
0.326
MAK-UNK-c8c8f7e2-12
0.326
MAK-UNK-c8c8f7e2-42
0.326
MAK-UNK-c8c8f7e2-7
0.322
MAK-UNK-7a704a63-23
0.322
MAK-UNK-7a704a63-24
0.318
MAK-UNK-c8c8f7e2-31
0.318
MAK-UNK-c8c8f7e2-40
0.318
MAK-UNK-7a704a63-17
0.318
BEN-VAN-5787f7d3-10
0.311
BEN-VAN-5787f7d3-1
0.308
MAK-UNK-7a704a63-1
0.306
MAK-UNK-c8c8f7e2-26
0.302
MAK-UNK-c8c8f7e2-10
0.302
MAK-UNK-7a704a63-5
0.302
MAK-UNK-7a704a63-13
0.302
MAK-UNK-7a704a63-12
0.302
MAK-UNK-7a704a63-4
0.299
MAK-UNK-c8c8f7e2-9
0.299
DOU-UNK-b5326f8f-9
0.294
BEN-VAN-5787f7d3-11
0.292
MAK-UNK-c8c8f7e2-38
0.292
MAK-UNK-7a704a63-19
0.287
MAK-UNK-c8c8f7e2-36
0.287
MAK-UNK-7a704a63-14
0.286
MAK-UNK-c8c8f7e2-28
0.286
MAK-UNK-c8c8f7e2-29
0.286
AAR-UNI-c25c2f1e-93
0.284
MAR-TRE-9d18ae8c-65
0.284
MAK-UNK-7a704a63-16
0.284
MAK-UNK-c8c8f7e2-39
0.284
MAR-TRE-7f7bb9f0-54
0.281
MAK-UNK-c8c8f7e2-21
0.281
MAK-UNK-c8c8f7e2-44
0.281
MAK-UNK-7a704a63-21
0.278
MAK-UNK-c8c8f7e2-37
0.278
MAR-TRE-7f7bb9f0-31
0.277