Molecular Properties | |
SMILES: | O=C1NC(=O)C2(CCC(NC(=O)c3cncnc3)CC2)N1 |
MW: | 289.12 |
Fraction sp3: | 0.46 |
HBA: | 5 |
HBD: | 3 |
Rotatable Bonds: | 2 |
TPSA: | 113.08 |
cLogP: | -0.27 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
hydantoin
MAR-TRE-c317dd82-88
0.462
MAR-TRE-e82e6c98-99
0.440
MAR-TRE-e82e6c98-65
0.437
MAR-TRE-e82e6c98-36
0.434
MAR-TRE-a9136c7b-89
0.421
MAR-TRE-c317dd82-46
0.403
MAR-TRE-c317dd82-80
0.403
MAR-TRE-4f781e27-76
0.400
MAR-TRE-a9136c7b-64
0.397
MAR-TRE-9d18ae8c-78
0.389
MAR-TRE-c317dd82-89
0.388
MAR-TRE-be9ff7d2-8
0.388
MAR-TRE-2fd8122f-18
0.382
MAR-TRE-e82e6c98-78
0.380
MAR-TRE-be9ff7d2-42
0.378
MAR-TRE-799db12b-29
0.373
MAR-TRE-c317dd82-69
0.370
MAR-TRE-c317dd82-44
0.367
MAR-TRE-be9ff7d2-69
0.360
MAR-TRE-e82e6c98-81
0.360
MAR-TRE-92684b97-57
0.357
MAR-TRE-92684b97-7
0.355
MAR-TRE-66ac689e-38
0.347
MAR-TRE-8190bb11-33
0.346
MAR-TRE-e82e6c98-96
0.341
MAR-TRE-be9ff7d2-19
0.338
MAR-TRE-4f781e27-7
0.338
MAR-TRE-e82e6c98-69
0.337
MAR-TRE-e82e6c98-41
0.333
MAR-TRE-be9ff7d2-41
0.333
MAR-TRE-9d18ae8c-96
0.333
MAR-TRE-9d18ae8c-98
0.333
MAR-TRE-8190bb11-65
0.333
MAR-TRE-e82e6c98-21
0.330
MAR-TRE-c317dd82-14
0.329
MAR-TRE-c317dd82-77
0.329
MAR-TRE-c317dd82-82
0.329
MAR-TRE-9d18ae8c-93
0.329
MAR-TRE-9d18ae8c-76
0.329
MAR-TRE-c317dd82-3
0.326
MAR-TRE-8190bb11-2
0.326
MAR-TRE-be9ff7d2-75
0.326
MAR-TRE-e82e6c98-53
0.325
MAR-TRE-e82e6c98-28
0.325
MAR-TRE-66ac689e-8
0.325
MAR-TRE-92684b97-95
0.325
MAR-TRE-c317dd82-18
0.325
MAR-TRE-92684b97-52
0.324
MAR-TRE-c317dd82-68
0.324
MAR-TRE-66ac689e-1
0.321
MAR-TRE-92684b97-62
0.321
MAR-TRE-c317dd82-4
0.321
MAR-TRE-4f781e27-22
0.321
MAR-TRE-92684b97-39
0.321
MAR-TRE-be9ff7d2-53
0.318
MAR-TRE-e82e6c98-33
0.318
MAR-TRE-9d18ae8c-38
0.317
MAR-TRE-92684b97-28
0.317
MAR-TRE-92684b97-20
0.316
MAR-TRE-c317dd82-98
0.315
MAR-TRE-c317dd82-40
0.312
MAR-TRE-c317dd82-34
0.312
MAR-TRE-e82e6c98-34
0.312
MAR-TRE-66ac689e-2
0.312
MAR-TRE-c317dd82-86
0.312
MAR-TRE-9d18ae8c-72
0.311
MAR-TRE-a9136c7b-7
0.310
MAR-TRE-a9136c7b-96
0.310
MAR-TRE-8190bb11-39
0.310
MAR-TRE-4f781e27-18
0.310
MAR-TRE-c317dd82-87
0.308
MAR-TRE-be9ff7d2-76
0.308
MAR-TRE-8190bb11-75
0.307
MAR-TRE-be9ff7d2-88
0.307
MAR-TRE-e82e6c98-47
0.307
MAR-TRE-8190bb11-79
0.305
MAR-TRE-4f781e27-35
0.305
MAR-TRE-4f781e27-31
0.304
MAR-TRE-c317dd82-65
0.303
MAR-TRE-c317dd82-53
0.303
MAR-TRE-799db12b-51
0.302
MAR-TRE-799db12b-57
0.302
MAR-TRE-be9ff7d2-74
0.301
MAR-TRE-9d18ae8c-61
0.301
MAR-TRE-a9136c7b-97
0.301
MAR-TRE-799db12b-7
0.301
MAR-TRE-92684b97-37
0.301
MAR-TRE-be9ff7d2-70
0.300
MAR-TRE-be9ff7d2-22
0.300
MAR-TRE-8190bb11-41
0.300
MAR-TRE-8190bb11-56
0.300
MAR-TRE-799db12b-21
0.299
MAR-TRE-e82e6c98-86
0.299
MAR-TRE-be9ff7d2-62
0.299
MAR-TRE-9d18ae8c-15
0.299
MAR-TRE-e82e6c98-55
0.299
MAR-TRE-e82e6c98-40
0.298
MAR-TRE-4f781e27-79
0.298
MAR-TRE-e82e6c98-44
0.296
MAR-TRE-9d18ae8c-2
0.296