Molecular Properties | |
SMILES: | CC(=O)Nc1cc(C)cc(N2CCCC2=O)c1 |
MW: | 232.12 |
Fraction sp3: | 0.38 |
HBA: | 2 |
HBD: | 1 |
Rotatable Bonds: | 2 |
TPSA: | 49.41 |
cLogP: | 2.08 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✔️ |
LON-WEI-8f408cad-3
MAK-UNK-c8c8f7e2-40
1.000
MAK-UNK-7a704a63-20
0.636
MAK-UNK-7a704a63-23
0.603
MAK-UNK-6435e6c2-4
0.508
MAK-UNK-7a704a63-6
0.492
MAK-UNK-c8c8f7e2-11
0.492
MAK-UNK-7a704a63-18
0.468
MAK-UNK-c8c8f7e2-41
0.468
MAK-UNK-c8c8f7e2-15
0.429
MAK-UNK-7a704a63-8
0.429
MAK-UNK-7a704a63-24
0.424
MAK-UNK-c8c8f7e2-39
0.422
MAK-UNK-7a704a63-16
0.422
MAK-UNK-c8c8f7e2-12
0.415
MAK-UNK-7a704a63-7
0.415
MAK-UNK-c8c8f7e2-16
0.409
MAK-UNK-7a704a63-5
0.406
MAK-UNK-c8c8f7e2-10
0.406
MAK-UNK-7a704a63-9
0.403
MAK-UNK-c8c8f7e2-17
0.391
MAK-UNK-c8c8f7e2-1
0.385
MAK-UNK-7a704a63-22
0.382
LON-WEI-8f408cad-1
0.382
MAK-UNK-7a704a63-10
0.382
MAK-UNK-10dfa458-22
0.382
AAR-POS-0daf6b7e-11
0.382
MAK-UNK-10dfa458-3
0.382
MAK-UNK-c8c8f7e2-18
0.366
MAK-UNK-c8c8f7e2-20
0.364
MAK-UNK-7a704a63-19
0.364
MAK-UNK-c8c8f7e2-36
0.364
MAK-UNK-c8c8f7e2-30
0.364
MAK-UNK-7a704a63-11
0.358
MAK-UNK-c8c8f7e2-2
0.358
MAK-UNK-c8c8f7e2-3
0.358
MAK-UNK-c8c8f7e2-4
0.358
MAR-TRE-67513f76-4
0.352
MAK-UNK-c8c8f7e2-38
0.348
MAK-UNK-7a704a63-4
0.338
MAK-UNK-c8c8f7e2-9
0.338
MAK-UNK-c8c8f7e2-6
0.338
MAK-UNK-c8c8f7e2-5
0.333
MAK-UNK-902cc841-3
0.329
MAK-UNK-9159f8ed-6
0.329
MAK-UNK-1e8f9e3c-1
0.329
MAR-TRE-7f7bb9f0-54
0.329
MAK-UNK-7a704a63-21
0.329
MAK-UNK-c8c8f7e2-37
0.329
MAK-UNK-9159f8ed-2
0.322
MAR-TRE-7f7bb9f0-31
0.321
MAK-UNK-c8c8f7e2-43
0.319
MAK-UNK-902cc841-4
0.318
MAK-UNK-1e8f9e3c-4
0.318
MAK-UNK-1e8f9e3c-2
0.318
MAK-UNK-1e8f9e3c-5
0.317
MAK-UNK-9159f8ed-3
0.317
MAK-UNK-1e8f9e3c-3
0.317
MAK-UNK-c8c8f7e2-8
0.315
MAK-UNK-c8c8f7e2-42
0.314
MAK-UNK-c8c8f7e2-34
0.314
MAK-UNK-c8c8f7e2-7
0.311
MAK-UNK-1e8f9e3c-6
0.310
MAK-UNK-9159f8ed-4
0.308
MAK-UNK-9159f8ed-5
0.307
MAK-UNK-9159f8ed-7
0.306
MAR-TRE-2fd8122f-39
0.305
MAK-UNK-c8c8f7e2-14
0.304
MAK-UNK-7a704a63-2
0.304
MAK-UNK-c8c8f7e2-13
0.300
MAK-UNK-7a704a63-3
0.300
AAR-UNI-c25c2f1e-61
0.299
MAK-UNK-10dfa458-25
0.299
MAK-UNK-c8c8f7e2-25
0.297
MAK-UNK-9159f8ed-1
0.297
MAK-UNK-c8c8f7e2-44
0.296
MAK-UNK-c8c8f7e2-33
0.296
MAR-TRE-799db12b-69
0.289
MAK-UNK-c8c8f7e2-31
0.288
MAK-UNK-7a704a63-13
0.286
MAK-UNK-7a704a63-12
0.286
MAK-UNK-c8c8f7e2-26
0.286
MAK-UNK-c8c8f7e2-29
0.284
MAR-TRE-799db12b-49
0.282
MAK-UNK-10dfa458-32
0.281
MAK-UNK-c8c8f7e2-32
0.280
DOU-UNK-b5326f8f-9
0.280
MAK-UNK-c8c8f7e2-21
0.278
MAK-UNK-10dfa458-23
0.278
MAK-UNK-7a704a63-1
0.271
MAK-UNK-7a704a63-14
0.267
BAR-COM-0f94fc3d-53
0.267
BEN-VAN-5787f7d3-6
0.267
MAK-UNK-c8c8f7e2-28
0.267
MAR-TRE-67513f76-35
0.264
MAK-UNK-c8c8f7e2-27
0.264
MAK-UNK-7a704a63-15
0.263
MAK-UNK-c8c8f7e2-23
0.263
MAT-POS-b5746674-55
0.261
AAR-UNI-c25c2f1e-103
0.258
MAK-UNK-c8c8f7e2-19
0.254