| General Property |
| Molceule ID (DB) | EGIN0002298 |
| Inhibitor Class | Thiazolo-pyrimidine |
| Molecule Name in Refrence Article | 6b compound |
| IUPAC Name | 4-{[7-(phenylamino)-[1,3]thiazolo[4,5-d]pyrimidin-2-yl]amino}benzene-1-sulfonamide |
| Formula | C17H14N6O2S2 |
| Mass | 398.462 |
| Exact Mass | 398.0619651 |
| Composition | C (51.24%), H (3.54%), N (21.09%), O (8.03%), S (16.09%) |
| Atom Count | 41 |
| PI | 7.05 |
| Smiles | n1c(sc2c1ncnc2Nc1ccccc1)Nc1ccc(cc1)S(=O)(=O)N |
| InChI | 1S/C17H14N6O2S2/c18-27(24,25)13-8-6-12(7-9-13)22-17-23-16-14(26-17)15(19-10-20-16)21-11-4-2-1-3-5-11
/h1-10H,(H2,18,24,25)(H2,19,20,21,22,23) |
| InChIKey | VFKYFVARGWUQHK-UHFFFAOYSA-N |
| 2D Structure |  | Structure Backbone |  |
|
| 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 | 19286381 |
| 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 |
44592167
|
| Drug Bank Link | - |
| ChemSpider Link | 24714126 |
| ChEMBL Link | CHEMBL511839 |
