Molecular Properties | |
SMILES: | CN(C)C(=O)CC1CCCCC1NC(=O)c1cncnc1 |
MW: | 290.17 |
Fraction sp3: | 0.6 |
HBA: | 4 |
HBD: | 1 |
Rotatable Bonds: | 4 |
TPSA: | 75.19 |
cLogP: | 1.24 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
MAR-TRE-92684b97-62
0.774
MAR-TRE-92684b97-57
0.531
MAR-TRE-be9ff7d2-69
0.458
MAR-TRE-9d18ae8c-93
0.444
MAR-TRE-e82e6c98-81
0.400
MAR-TRE-a9136c7b-96
0.378
MAR-TRE-c317dd82-77
0.367
MAR-TRE-e82e6c98-86
0.365
MAR-TRE-e82e6c98-65
0.364
MAR-TRE-92684b97-70
0.362
MAR-TRE-e82e6c98-53
0.361
MAR-TRE-c317dd82-88
0.361
MAR-TRE-799db12b-92
0.360
MAR-TRE-be9ff7d2-75
0.360
MAR-TRE-be9ff7d2-52
0.356
MAR-TRE-8190bb11-41
0.354
MAR-TRE-be9ff7d2-22
0.354
MAR-TRE-92684b97-28
0.354
MAR-TRE-e82e6c98-78
0.349
MAR-TRE-be9ff7d2-42
0.346
MAR-TRE-c317dd82-18
0.346
MAR-TRE-e82e6c98-28
0.346
MAR-TRE-92684b97-83
0.342
MAR-TRE-be9ff7d2-30
0.341
MAR-TRE-4f781e27-77
0.341
MAR-TRE-9d18ae8c-38
0.337
MAR-TRE-799db12b-57
0.337
MAR-TRE-c317dd82-46
0.333
MAR-TRE-9d18ae8c-76
0.333
MAR-TRE-e82e6c98-44
0.333
MAR-TRE-a9136c7b-86
0.333
MAR-TRE-c317dd82-34
0.333
MAR-TRE-a9136c7b-47
0.329
MAR-TRE-92684b97-52
0.329
MAR-TRE-a9136c7b-95
0.326
MAR-TRE-799db12b-29
0.325
MAR-TRE-c317dd82-65
0.322
MAR-TRE-799db12b-13
0.322
MAR-TRE-799db12b-71
0.322
MAR-TRE-be9ff7d2-53
0.322
MAR-TRE-a9136c7b-89
0.321
MAR-TRE-8190bb11-56
0.321
MAR-TRE-be9ff7d2-41
0.321
MAR-TRE-c317dd82-8
0.321
MAR-TRE-9d18ae8c-31
0.321
MAR-TRE-9d18ae8c-96
0.319
MAR-TRE-e82e6c98-21
0.319
MAR-TRE-a9136c7b-2
0.318
MAR-TRE-4f781e27-79
0.318
MAR-TRE-e82e6c98-56
0.317
MAR-TRE-9d18ae8c-95
0.316
MAR-TRE-e82e6c98-96
0.315
MAR-TRE-4f781e27-18
0.314
MAR-TRE-c317dd82-49
0.312
MAR-TRE-c317dd82-89
0.310
MAR-TRE-799db12b-27
0.310
MAR-TRE-be9ff7d2-19
0.309
MAR-TRE-8190bb11-69
0.309
MAR-TRE-92684b97-7
0.309
MAR-TRE-4f781e27-8
0.308
MAR-TRE-be9ff7d2-20
0.308
MAR-TRE-a9136c7b-63
0.308
MAR-TRE-c317dd82-85
0.307
MAR-TRE-9d18ae8c-61
0.307
MAR-TRE-e82e6c98-94
0.307
MAR-TRE-799db12b-7
0.306
MAR-TRE-c317dd82-44
0.306
MAR-TRE-4f781e27-90
0.305
MAR-TRE-92684b97-20
0.305
MAR-TRE-9d18ae8c-78
0.304
MAR-TRE-be9ff7d2-62
0.303
MAR-TRE-e82e6c98-41
0.303
MAR-TRE-c317dd82-14
0.302
MAR-TRE-be9ff7d2-55
0.302
MAR-TRE-a9136c7b-64
0.302
MAR-TRE-4f781e27-76
0.301
MAR-TRE-e82e6c98-34
0.301
MAR-TRE-c317dd82-82
0.300
MAR-TRE-9d18ae8c-32
0.299
MAR-TRE-c317dd82-74
0.299
MAR-TRE-e82e6c98-73
0.298
MAR-TRE-c317dd82-6
0.298
MAR-TRE-a9136c7b-29
0.297
MAR-TRE-e82e6c98-22
0.296
MAR-TRE-e82e6c98-48
0.296
MAR-TRE-4f781e27-64
0.296
MAR-TRE-c317dd82-87
0.296
MAR-TRE-be9ff7d2-8
0.295
MAR-TRE-799db12b-62
0.295
MAR-TRE-be9ff7d2-88
0.295
MAR-TRE-4f781e27-41
0.295
MAR-TRE-be9ff7d2-35
0.294
MAR-TRE-e82e6c98-8
0.294
MAR-TRE-be9ff7d2-12
0.294
MAR-TRE-92684b97-100
0.294
MAR-TRE-c317dd82-67
0.293
MAR-TRE-a9136c7b-83
0.293
GIA-UNK-d2defdc3-2
0.293
MAR-TRE-c317dd82-68
0.293
MAR-TRE-e82e6c98-1
0.293