General Property |
Molceule ID (DB) | EGIN0004722 |
Inhibitor Class | Nicotinamide |
Molecule Name in Refrence Article | 20 |
IUPAC Name | 6-chloro-N-[(4-chlorophenyl)sulfonyl]pyridine-3-carboxamide |
Formula | C12H8Cl2N2O3S |
Mass | 331.175 |
Exact Mass | 329.9632682 |
Composition | C (43.52%), H (2.43%), Cl (21.41%), N (8.46%), O (14.49%), S (9.68%) |
Atom Count | 28 |
PI | 1.91 |
Smiles | c1cc(ncc1C(=O)NS(=O)(=O)c1ccc(cc1)Cl)Cl |
InChI | 1S/C12H8Cl2N2O3S/c13-9-2-4-10(5-3-9)20(18,19)16-12(17)8-1-6-11(14)15-7-8/h1-7H,(H,16,17) |
InChIKey | RHWDALMOXXJFOR-UHFFFAOYSA-N |
2D Structure | ![](./image/EGIN0004722.png) | Structure Backbone | ![](./frame/f_EGIN0004722.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 |
57397974
|
Drug Bank Link | - |
ChemSpider Link | 28431280 |
ChEMBL Link | CHEMBL1945645 |