Molecular Properties | |
SMILES: | O=C(NCCCN1C(=O)NC2(CCCC2)C1=O)c1cncnc1 |
MW: | 317.15 |
Fraction sp3: | 0.53 |
HBA: | 5 |
HBD: | 2 |
Rotatable Bonds: | 5 |
TPSA: | 104.29 |
cLogP: | 0.46 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Aliphatic long chain
hydantoin
MAR-TRE-4f781e27-7
0.931
MAR-TRE-e82e6c98-26
0.529
MAR-TRE-8190bb11-96
0.522
MAR-TRE-c317dd82-92
0.459
MAR-TRE-be9ff7d2-41
0.438
MAR-TRE-e82e6c98-47
0.431
MAR-TRE-e82e6c98-22
0.408
MAR-TRE-a9136c7b-23
0.407
MAR-TRE-be9ff7d2-32
0.392
MAR-TRE-8190bb11-2
0.382
MAR-TRE-e82e6c98-50
0.380
MAR-TRE-66ac689e-59
0.377
MAR-TRE-b77b7921-91
0.370
MAR-TRE-c317dd82-70
0.370
MAR-TRE-66ac689e-47
0.369
MAR-TRE-4b834d9a-90
0.368
MAR-TRE-be9ff7d2-19
0.367
MAR-TRE-8190bb11-30
0.366
MAR-TRE-e82e6c98-29
0.362
MAR-TRE-92684b97-37
0.361
MAR-TRE-4f781e27-58
0.358
MAR-TRE-4f781e27-76
0.358
MAR-TRE-e82e6c98-36
0.357
MAR-TRE-799db12b-68
0.357
MAR-TRE-e82e6c98-85
0.356
MAR-TRE-74c6519b-53
0.354
MAR-TRE-e82e6c98-60
0.354
MAR-TRE-66ac689e-35
0.354
MAR-TRE-8190bb11-39
0.353
MAR-TRE-799db12b-21
0.351
MAR-TRE-66ac689e-91
0.349
MAR-TRE-8190bb11-64
0.348
MAR-TRE-8190bb11-85
0.347
MAR-TRE-c317dd82-8
0.346
MAR-TRE-be9ff7d2-70
0.346
MAR-TRE-be9ff7d2-92
0.345
MAR-TRE-e82e6c98-5
0.345
MAR-TRE-e82e6c98-64
0.345
MAR-TRE-8190bb11-46
0.345
MAR-TRE-4f781e27-65
0.345
MAR-TRE-e82e6c98-35
0.341
MAR-TRE-799db12b-65
0.341
MAR-TRE-c317dd82-68
0.338
MAR-TRE-4f781e27-85
0.338
MAR-TRE-92684b97-52
0.338
MAR-TRE-be9ff7d2-42
0.338
MAR-TRE-66ac689e-20
0.337
MAR-TRE-c317dd82-26
0.337
MAR-TRE-9d18ae8c-13
0.337
MAR-TRE-be9ff7d2-11
0.333
MAR-TRE-be9ff7d2-77
0.333
MAR-TRE-e82e6c98-57
0.333
MAR-TRE-e82e6c98-93
0.333
MAR-TRE-799db12b-29
0.333
MAR-TRE-66ac689e-21
0.333
MAR-TRE-799db12b-11
0.330
MAR-TRE-c317dd82-81
0.329
MAR-TRE-b77b7921-63
0.329
MAR-TRE-66ac689e-29
0.329
MAR-TRE-be9ff7d2-54
0.329
MAR-TRE-e82e6c98-12
0.329
MAR-TRE-66ac689e-26
0.329
MAR-TRE-be9ff7d2-40
0.329
MAR-TRE-e82e6c98-76
0.329
MAR-TRE-9d18ae8c-89
0.329
MAR-TRE-e82e6c98-41
0.329
MAR-TRE-8190bb11-24
0.329
MAR-TRE-be9ff7d2-67
0.329
MAR-TRE-799db12b-14
0.326
MAR-TRE-e82e6c98-37
0.326
MAR-TRE-e82e6c98-92
0.326
MAR-TRE-799db12b-64
0.326
MAR-TRE-be9ff7d2-18
0.325
MAR-TRE-be9ff7d2-94
0.325
RAF-POL-b61b4b25-5
0.325
MAR-TRE-c317dd82-75
0.323
MAR-TRE-c317dd82-22
0.323
MAR-TRE-e82e6c98-49
0.322
MAR-TRE-9d18ae8c-66
0.322
MAR-TRE-799db12b-72
0.322
MAR-TRE-be9ff7d2-89
0.321
MAR-TRE-8190bb11-95
0.321
MAR-TRE-4f781e27-92
0.321
MAR-TRE-c317dd82-55
0.321
MAR-TRE-e82e6c98-48
0.321
MAR-TRE-e82e6c98-75
0.321
MAR-TRE-92684b97-38
0.321
MAR-TRE-e82e6c98-54
0.321
MAR-TRE-8190bb11-13
0.321
MAR-TRE-92684b97-78
0.320
MAR-TRE-c317dd82-51
0.319
MAR-TRE-e82e6c98-82
0.318
MAR-TRE-66ac689e-1
0.318
MAR-TRE-4f781e27-23
0.318
MAR-TRE-799db12b-89
0.318
MAR-TRE-8190bb11-86
0.318
MAR-TRE-8190bb11-88
0.318
MAR-TRE-c317dd82-4
0.318
MAR-TRE-be9ff7d2-14
0.318
MAR-TRE-8190bb11-73
0.318