Molecular Properties | |
SMILES: | N#Cc1cccnc1S(=O)(=O)NC(=O)c1cncnc1 |
MW: | 289.03 |
Fraction sp3: | 0.0 |
HBA: | 7 |
HBD: | 1 |
Rotatable Bonds: | 3 |
TPSA: | 125.7 |
cLogP: | -0.14 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Hetero_hetero
MAR-TRE-a9136c7b-84
0.576
MAR-TRE-92684b97-21
0.523
MAR-TRE-8190bb11-44
0.493
MAR-TRE-92684b97-59
0.485
MAR-TRE-c317dd82-28
0.471
MAR-TRE-92684b97-60
0.471
MAR-TRE-be9ff7d2-31
0.471
MAR-TRE-4f781e27-95
0.471
MAR-TRE-8190bb11-1
0.457
MAR-TRE-8190bb11-60
0.457
MAR-TRE-92684b97-9
0.457
MAR-TRE-92684b97-58
0.452
MAR-TRE-92684b97-90
0.446
MAR-TRE-8190bb11-84
0.444
MAR-TRE-8190bb11-15
0.444
MAR-TRE-92684b97-69
0.444
MAR-TRE-c317dd82-43
0.435
MAR-TRE-a9136c7b-39
0.429
MAR-TRE-4f781e27-61
0.423
MAR-TRE-be9ff7d2-58
0.423
MAR-TRE-4f781e27-62
0.423
MAR-TRE-92684b97-40
0.423
MAR-TRE-a9136c7b-41
0.421
MAR-TRE-799db12b-30
0.418
MAR-TRE-be9ff7d2-23
0.417
MAR-TRE-9d18ae8c-63
0.417
MAR-TRE-92684b97-42
0.416
MAR-TRE-66ac689e-39
0.405
MAR-TRE-8190bb11-29
0.403
MAR-TRE-4f781e27-30
0.403
MAR-TRE-4f781e27-54
0.400
MAR-TRE-8190bb11-53
0.397
MAR-TRE-4f781e27-46
0.394
MAR-TRE-92684b97-13
0.392
MAR-TRE-66ac689e-13
0.392
MAR-TRE-8190bb11-37
0.392
MAR-TRE-be9ff7d2-13
0.392
MAR-TRE-a9136c7b-87
0.390
MAR-TRE-92684b97-65
0.390
MAR-TRE-a9136c7b-75
0.389
MAR-TRE-4f781e27-72
0.389
MAR-TRE-9d18ae8c-25
0.387
MAR-TRE-92684b97-24
0.387
MAR-TRE-e82e6c98-63
0.386
MAR-TRE-9d18ae8c-70
0.385
MAR-TRE-a9136c7b-20
0.384
MAR-TRE-8190bb11-32
0.384
MAR-TRE-8190bb11-57
0.384
MAR-TRE-4f781e27-87
0.384
MAR-TRE-a9136c7b-40
0.384
MAR-TRE-4f781e27-50
0.384
MAR-TRE-a9136c7b-92
0.378
MAR-TRE-4f781e27-17
0.378
MAR-TRE-4f781e27-42
0.378
MAR-TRE-a9136c7b-56
0.378
MAR-TRE-66ac689e-32
0.378
MAR-TRE-92684b97-48
0.378
MAR-TRE-a9136c7b-88
0.378
MAR-TRE-e82e6c98-58
0.377
MAR-TRE-66ac689e-6
0.377
MAR-TRE-4f781e27-63
0.377
MAR-TRE-66ac689e-50
0.377
MAR-TRE-9d18ae8c-47
0.377
MAR-TRE-8190bb11-78
0.373
MAR-TRE-a9136c7b-3
0.373
MAR-TRE-a9136c7b-60
0.372
MAR-TRE-799db12b-88
0.372
MAR-TRE-66ac689e-44
0.372
MAR-TRE-8190bb11-21
0.370
MAR-TRE-799db12b-81
0.370
MAR-TRE-9d18ae8c-44
0.370
MAR-TRE-92684b97-30
0.370
MAR-TRE-be9ff7d2-63
0.370
MAR-TRE-799db12b-10
0.368
MAR-TRE-a9136c7b-15
0.368
MAR-TRE-66ac689e-16
0.368
MAR-TRE-92684b97-34
0.368
MAR-TRE-c317dd82-100
0.368
MAR-TRE-8190bb11-63
0.367
MAR-TRE-8190bb11-87
0.367
MAR-TRE-9d18ae8c-56
0.367
MAR-TRE-9d18ae8c-75
0.367
MAR-TRE-4f781e27-90
0.364
MAR-TRE-9d18ae8c-100
0.364
MAR-TRE-c317dd82-1
0.364
MAR-TRE-799db12b-38
0.364
MAR-TRE-8190bb11-3
0.364
MAR-TRE-8190bb11-45
0.364
MAR-TRE-4f781e27-15
0.364
MAR-TRE-be9ff7d2-45
0.364
MAR-TRE-8190bb11-77
0.364
MAR-TRE-4f781e27-66
0.362
MAR-TRE-9d18ae8c-5
0.361
MAR-TRE-e82e6c98-89
0.360
MAR-TRE-e82e6c98-45
0.360
MAR-TRE-799db12b-5
0.359
MAR-TRE-799db12b-53
0.359
MAR-TRE-66ac689e-63
0.359
MAR-TRE-8190bb11-94
0.358
MAR-TRE-a9136c7b-68
0.358