Molecular Properties | |
SMILES: | CC1(C)C(=O)NC(=O)N1CC(=O)Nc1ccc(N)nc1 |
MW: | 277.12 |
Fraction sp3: | 0.33 |
HBA: | 5 |
HBD: | 3 |
Rotatable Bonds: | 3 |
TPSA: | 117.42 |
cLogP: | -0.07 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Source | |
MolPort: | MolPort-045-471-718 |
hydantoin
aniline
MAR-TRE-74c6519b-53
0.486
MAR-TRE-b77b7921-63
0.473
MAR-TRE-04c86cea-44
0.450
MAR-TRE-67513f76-99
0.449
MAR-TRE-67513f76-3
0.446
MAR-TRE-04c86cea-62
0.439
MAR-TRE-7f7bb9f0-45
0.432
MAR-TRE-9c797165-70
0.414
MAR-TRE-e82e6c98-7
0.414
MAR-TRE-67513f76-44
0.411
MAR-TRE-4b834d9a-89
0.411
MAR-TRE-d0525fbf-82
0.405
MAR-TRE-3e4e6814-87
0.392
MAR-TRE-7f7bb9f0-86
0.392
MAR-TRE-7f7bb9f0-99
0.390
MAR-TRE-74c6519b-12
0.388
MAR-TRE-9c797165-2
0.387
MAR-TRE-67513f76-14
0.387
MAR-TRE-3e4e6814-39
0.382
MAR-TRE-7f7bb9f0-14
0.375
MAR-TRE-7f7bb9f0-63
0.375
MAR-TRE-67513f76-47
0.373
MAR-TRE-74c6519b-46
0.372
MAR-TRE-9c797165-33
0.370
MAR-TRE-9c797165-77
0.370
MAR-TRE-9c797165-44
0.366
MAR-TRE-67513f76-35
0.365
MAR-TRE-9c797165-84
0.355
MAR-TRE-f6f5f473-73
0.354
MAR-TRE-9c797165-4
0.346
MAR-TRE-67513f76-31
0.345
MAR-TRE-f6f5f473-56
0.342
MAR-TRE-74c6519b-52
0.338
MAR-TRE-3e4e6814-58
0.338
MAR-TRE-7f7bb9f0-67
0.337
MAR-TRE-74c6519b-29
0.337
MAR-TRE-3e4e6814-96
0.333
MAR-TRE-7f7bb9f0-21
0.333
MAR-TRE-67513f76-75
0.333
MAR-TRE-74c6519b-48
0.333
MAR-TRE-04c86cea-38
0.333
MAR-TRE-7f7bb9f0-11
0.329
MAR-TRE-b77b7921-72
0.326
MAR-TRE-7f7bb9f0-47
0.321
MAR-TRE-f6f5f473-28
0.321
MAR-TRE-74c6519b-50
0.318
MAR-TRE-04c86cea-78
0.318
MAR-TRE-f6f5f473-91
0.318
MAR-TRE-d0525fbf-30
0.315
MAR-TRE-f6f5f473-69
0.314
MAR-TRE-f6f5f473-97
0.312
MAR-TRE-f6f5f473-90
0.310
MAR-TRE-f6f5f473-77
0.302
MAR-TRE-f6f5f473-14
0.300
MAR-TRE-4b834d9a-58
0.299
MAR-TRE-3e4e6814-23
0.299
MAR-TRE-f6f5f473-8
0.295
MAR-TRE-7f7bb9f0-13
0.290
MAR-TRE-4b834d9a-65
0.289
MAR-TRE-74c6519b-24
0.289
MAR-TRE-f6f5f473-9
0.281
MAR-TRE-3e4e6814-16
0.280
MAR-TRE-f6f5f473-39
0.279
MAR-TRE-3e4e6814-22
0.277
MAR-TRE-f6f5f473-74
0.276
MAR-TRE-04c86cea-84
0.275
MAR-TRE-b77b7921-91
0.274
MAR-TRE-6c5ef77a-92
0.270
MAR-TRE-04c86cea-34
0.269
KEI-TRE-d5e2018a-45
0.267
MAR-TRE-f6f5f473-37
0.267
MAR-TRE-3e4e6814-66
0.267
MAR-TRE-67513f76-24
0.264
MAR-TRE-67513f76-60
0.264
MAR-TRE-9c797165-60
0.264
MAR-TRE-2fd8122f-68
0.264
MAR-TRE-b77b7921-9
0.263
MAR-TRE-d0525fbf-99
0.263
MAR-TRE-a3327163-32
0.262
MAR-TRE-6c5ef77a-35
0.261
MAR-TRE-67513f76-85
0.259
MAR-TRE-4b834d9a-96
0.258
MAR-TRE-67513f76-74
0.256
MAR-TRE-67513f76-73
0.256
MAR-TRE-04c86cea-85
0.256
MAR-TRE-04c86cea-19
0.256
MAR-TRE-0fda4e82-96
0.256
MAR-TRE-b77b7921-52
0.256
MAR-TRE-f6f5f473-46
0.256
MAR-TRE-6c5ef77a-12
0.255
MAR-TRE-d0525fbf-50
0.255
MAR-TRE-67513f76-90
0.253
MAR-TRE-7f7bb9f0-26
0.253
MAR-TRE-7f7bb9f0-37
0.253
EDG-MED-0da5ad92-13
0.250
MAR-TRE-4b834d9a-78
0.250
MAR-TRE-f5c2d31c-10
0.250
MAR-TRE-74c6519b-69
0.250
MAR-TRE-6c5ef77a-16
0.250
MAR-TRE-6c5ef77a-45
0.250