| General Property |
| Molceule ID (DB) | EGIN0003435 |
| Inhibitor Class | Amino-thiazole |
| Molecule Name in Refrence Article | 12m compound |
| IUPAC Name | N-(2-chloro-6-methylphenyl)-2-[(2,6-dimethylpyrimidin-4-yl)amino]-1,3-thiazole-5-carboxamide |
| Formula | C17H16ClN5OS |
| Mass | 373.86 |
| Exact Mass | 373.0764086 |
| Composition | C (54.61%), H (4.31%), Cl (9.48%), N (18.73%), O (4.28%), S (8.58%) |
| Atom Count | 41 |
| PI | 7.15 |
| Smiles | c1(sc(nc1)Nc1nc(nc(c1)C)C)C(=O)Nc1c(Cl)cccc1C |
| InChI | 1S/C17H16ClN5OS/c1-9-5-4-6-12(18)15(9)23-16(24)13-8-19-17(25-13)22-14-7-10(2)20-11(3)21-14/h4-8H,1-3
H3,(H,23,24)(H,19,20,21,22) |
| InChIKey | WFRLFWGASBLYTC-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 | 17154512 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | Bcr-Abl | Cdk2 | FGFR1 | Fyn | Hck | Lck | Lyn | p38 | Src | Yes | ALL |
| Pub Chem Link |
11153014
|
| Drug Bank Link | - |
| ChemSpider Link | 9328122 |
| ChEMBL Link | CHEMBL364623 |
