Molecular Properties | |
SMILES: | O=C1NC(=O)C(c2ccc(NC(=O)c3cncnc3)cc2)N1 |
MW: | 297.09 |
Fraction sp3: | 0.07 |
HBA: | 5 |
HBD: | 3 |
Rotatable Bonds: | 3 |
TPSA: | 113.08 |
cLogP: | 0.61 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
hydantoin
MAR-TRE-66ac689e-2
0.591
MAR-TRE-9d18ae8c-15
0.562
MAR-TRE-4f781e27-31
0.561
MAR-TRE-9d18ae8c-29
0.479
MAR-TRE-66ac689e-51
0.425
MAR-TRE-9d18ae8c-58
0.425
MAR-TRE-4f781e27-12
0.414
MAR-TRE-66ac689e-88
0.408
MAR-TRE-8190bb11-7
0.408
MAR-TRE-9d18ae8c-2
0.400
MAR-TRE-8190bb11-69
0.392
MAR-TRE-a9136c7b-9
0.390
MAR-TRE-799db12b-93
0.375
MAR-TRE-be9ff7d2-41
0.370
MAR-TRE-799db12b-7
0.367
MAR-TRE-799db12b-17
0.365
MAR-TRE-c317dd82-87
0.360
MAR-TRE-66ac689e-8
0.359
MAR-TRE-4f781e27-1
0.357
MAR-TRE-be9ff7d2-20
0.356
MAR-TRE-92684b97-25
0.354
MAR-TRE-a9136c7b-42
0.350
MAR-TRE-a9136c7b-89
0.350
MAR-TRE-a9136c7b-64
0.346
MAR-TRE-799db12b-26
0.345
MAR-TRE-9d18ae8c-39
0.343
MAR-TRE-a9136c7b-57
0.341
MAR-TRE-c317dd82-8
0.333
MAR-TRE-e82e6c98-99
0.333
MAR-TRE-92684b97-45
0.333
MAR-TRE-66ac689e-31
0.333
MAR-TRE-c317dd82-23
0.330
MAR-TRE-be9ff7d2-46
0.329
MAR-TRE-c317dd82-16
0.325
MAR-TRE-799db12b-34
0.325
MAR-TRE-66ac689e-46
0.325
MAR-TRE-be9ff7d2-69
0.325
MAR-TRE-92684b97-52
0.324
MAR-TRE-a9136c7b-99
0.321
MAR-TRE-66ac689e-30
0.321
MAR-TRE-e82e6c98-80
0.320
MAR-TRE-8190bb11-42
0.320
MAR-TRE-66ac689e-29
0.317
MAR-TRE-66ac689e-76
0.317
MAR-TRE-4f781e27-13
0.317
MAR-TRE-92684b97-37
0.317
MAR-TRE-8190bb11-46
0.317
MAR-TRE-8190bb11-56
0.316
MAR-TRE-e82e6c98-50
0.316
MAR-TRE-9d18ae8c-74
0.316
MAR-TRE-c317dd82-63
0.316
MAR-TRE-9d18ae8c-31
0.316
MAR-TRE-4f781e27-49
0.315
MAR-TRE-799db12b-4
0.315
MAR-TRE-9d18ae8c-96
0.314
MAR-TRE-a9136c7b-2
0.314
MAR-TRE-e82e6c98-10
0.313
MAR-TRE-66ac689e-24
0.313
MAR-TRE-e82e6c98-38
0.313
MAR-TRE-e82e6c98-35
0.312
MAR-TRE-799db12b-39
0.312
MAR-TRE-4f781e27-76
0.312
MAR-TRE-c317dd82-40
0.312
MAR-TRE-9d18ae8c-72
0.311
MAR-TRE-9d18ae8c-76
0.311
MAR-TRE-c317dd82-56
0.310
MAR-TRE-be9ff7d2-56
0.310
MAR-TRE-9d18ae8c-32
0.310
MAR-TRE-4f781e27-47
0.310
MAR-TRE-9d18ae8c-36
0.310
MAR-TRE-c317dd82-7
0.310
MAR-TRE-a9136c7b-96
0.310
MAR-TRE-92684b97-55
0.309
MAR-TRE-a9136c7b-34
0.309
MAR-TRE-e82e6c98-22
0.308
MAR-TRE-92684b97-95
0.308
MAR-TRE-799db12b-74
0.308
MAR-TRE-92684b97-38
0.308
MAR-TRE-be9ff7d2-88
0.307
MAR-TRE-799db12b-25
0.306
MAR-TRE-4f781e27-67
0.306
MAR-TRE-799db12b-40
0.306
MAR-TRE-c317dd82-68
0.306
MAR-TRE-799db12b-89
0.305
MAR-TRE-c317dd82-4
0.305
MAR-TRE-9d18ae8c-79
0.305
MAR-TRE-66ac689e-21
0.305
MAR-TRE-c317dd82-45
0.304
MAR-TRE-c317dd82-91
0.304
MAR-TRE-4f781e27-8
0.303
MAR-TRE-c317dd82-53
0.303
MAR-TRE-e82e6c98-74
0.303
MAR-TRE-9d18ae8c-71
0.303
MAR-TRE-799db12b-37
0.302
MAR-TRE-799db12b-51
0.302
MAR-TRE-9d18ae8c-61
0.301
MAR-TRE-c317dd82-88
0.301
MAR-TRE-92684b97-57
0.301
MAR-TRE-be9ff7d2-74
0.301
MAR-TRE-9d18ae8c-38
0.301