Molecular Properties | |
SMILES: | O=C1NC(=O)C2(CCOC(CNC(=O)c3cncnc3)C2)N1 |
MW: | 305.11 |
Fraction sp3: | 0.46 |
HBA: | 6 |
HBD: | 3 |
Rotatable Bonds: | 3 |
TPSA: | 122.31 |
cLogP: | -1.04 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
hydantoin
MAR-TRE-799db12b-21
0.552
MAR-TRE-4f781e27-76
0.443
MAR-TRE-c317dd82-8
0.434
MAR-TRE-c317dd82-4
0.432
MAR-TRE-c317dd82-40
0.425
MAR-TRE-e82e6c98-48
0.405
MAR-TRE-e82e6c98-40
0.405
MAR-TRE-799db12b-7
0.393
MAR-TRE-8190bb11-2
0.380
MAR-TRE-e82e6c98-2
0.376
MAR-TRE-799db12b-18
0.374
MAR-TRE-c317dd82-29
0.368
MAR-TRE-e82e6c98-61
0.365
MAR-TRE-66ac689e-67
0.360
MAR-TRE-c317dd82-86
0.357
MAR-TRE-8190bb11-33
0.357
MAR-TRE-c317dd82-50
0.356
MAR-TRE-be9ff7d2-51
0.352
MAR-TRE-8190bb11-39
0.352
MAR-TRE-c317dd82-33
0.352
MAR-TRE-a9136c7b-85
0.352
MAR-TRE-4f781e27-7
0.349
MAR-TRE-be9ff7d2-41
0.346
MAR-TRE-66ac689e-38
0.341
MAR-TRE-e82e6c98-10
0.341
MAR-TRE-4f781e27-75
0.341
MAR-TRE-92684b97-52
0.338
MAR-TRE-4f781e27-22
0.333
MAR-TRE-e82e6c98-3
0.333
MAR-TRE-66ac689e-1
0.333
MAR-TRE-be9ff7d2-79
0.333
MAR-TRE-8190bb11-46
0.330
MAR-TRE-c317dd82-37
0.330
MAR-TRE-be9ff7d2-70
0.329
MAR-TRE-e82e6c98-84
0.326
MAR-TRE-e82e6c98-4
0.326
MAR-TRE-e82e6c98-37
0.326
MAR-TRE-e82e6c98-85
0.326
MAR-TRE-e82e6c98-62
0.326
MAR-TRE-799db12b-59
0.326
MAR-TRE-c317dd82-34
0.326
MAR-TRE-e82e6c98-34
0.326
MAR-TRE-e82e6c98-71
0.325
MAR-TRE-a9136c7b-7
0.323
MAR-TRE-e82e6c98-6
0.322
MAR-TRE-c317dd82-25
0.322
MAR-TRE-c317dd82-6
0.322
MAR-TRE-e82e6c98-22
0.321
MAR-TRE-92684b97-95
0.321
MAR-TRE-be9ff7d2-59
0.320
MAR-TRE-be9ff7d2-33
0.320
MAR-TRE-c317dd82-51
0.319
MAR-TRE-c317dd82-47
0.316
MAR-TRE-c317dd82-12
0.315
MAR-TRE-c317dd82-60
0.315
MAR-TRE-be9ff7d2-91
0.315
MAR-TRE-be9ff7d2-81
0.315
MAR-TRE-be9ff7d2-54
0.315
MAR-TRE-799db12b-22
0.315
MAR-TRE-be9ff7d2-66
0.314
MAR-TRE-66ac689e-26
0.314
MAR-TRE-be9ff7d2-25
0.313
MAR-TRE-8190bb11-85
0.312
MAR-TRE-be9ff7d2-80
0.312
MAR-TRE-e82e6c98-56
0.310
MAR-TRE-be9ff7d2-24
0.309
MAR-TRE-e82e6c98-67
0.309
MAR-TRE-be9ff7d2-100
0.309
MAR-TRE-e82e6c98-49
0.309
MAR-TRE-4f781e27-53
0.309
MAR-TRE-9d18ae8c-55
0.308
MAR-TRE-9d18ae8c-84
0.307
MAR-TRE-be9ff7d2-69
0.306
MAR-TRE-c317dd82-87
0.306
MAR-TRE-be9ff7d2-77
0.304
MAR-TRE-be9ff7d2-99
0.304
MAR-TRE-a9136c7b-17
0.304
MAR-TRE-8190bb11-83
0.304
MAR-TRE-e82e6c98-82
0.304
MAR-TRE-92684b97-78
0.304
MAR-TRE-be9ff7d2-14
0.303
MAR-TRE-8190bb11-79
0.303
MAR-TRE-be9ff7d2-96
0.303
MAR-TRE-c317dd82-53
0.301
MAR-TRE-e82e6c98-26
0.301
MAR-TRE-be9ff7d2-2
0.301
MAR-TRE-be9ff7d2-57
0.301
MAR-TRE-be9ff7d2-95
0.301
MAR-TRE-a9136c7b-97
0.300
MAR-TRE-c317dd82-81
0.300
MAR-TRE-799db12b-4
0.299
MAR-TRE-be9ff7d2-40
0.299
MAR-TRE-e82e6c98-66
0.299
MAR-TRE-e82e6c98-55
0.298
MAR-TRE-e82e6c98-23
0.298
MAR-TRE-be9ff7d2-46
0.297
MAR-TRE-be9ff7d2-60
0.297
MAR-TRE-e82e6c98-41
0.296
MAR-TRE-8190bb11-24
0.296
MAR-TRE-c317dd82-75
0.296