General Property |
Molceule ID (DB) | EGIN0004699 |
Inhibitor Class | Nicotinamide |
Molecule Name in Refrence Article | 23 |
IUPAC Name | N-[(4-bromophenyl)sulfonyl]-2-chloro-6-methylpyridine-3-carboxamide |
Formula | C13H10BrClN2O3S |
Mass | 389.652 |
Exact Mass | 387.9284032 |
Composition | C (40.07%), H (2.59%), Br (20.51%), Cl (9.1%), N (7.19%), O (12.32%), S (8.23%) |
Atom Count | 31 |
PI | 2.43 |
Smiles | c1cc(nc(c1C(=O)NS(=O)(=O)c1ccc(cc1)Br)Cl)C |
InChI | 1S/C13H10BrClN2O3S/c1-8-2-7-11(12(15)16-8)13(18)17-21(19,20)10-5-3-9(14)4-6-10/h2-7H,1H3,(H,17,18) |
InChIKey | ARHVERBRASNVPZ-UHFFFAOYSA-N |
2D Structure | ![](./image/EGIN0004699.png) | Structure Backbone | ![](./frame/f_EGIN0004699.png) |
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View Structure in Jmol | Click to view 3 d structure Download Mol File |
Drug Like Property | Druglikeliness |
Symmetry & Geometry | Symmetry And Geometrical Information |
Activity & Binding | Activity against isoform and covalant binding information |
Topological Properties | Descriptors |
Reference | 22277588 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | No activity data against other kinases present in database |
Pub Chem Link |
57394394
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Drug Bank Link | - |
ChemSpider Link | 28480000 |
ChEMBL Link | CHEMBL1945648 |