| General Property |
| Molceule ID (DB) | EGIN0003096 |
| Inhibitor Class | Pyrimidine |
| Molecule Name in Refrence Article | 11 compound |
| IUPAC Name | N-{3-chloro-4-[(3-fluorophenyl)methoxy]phenyl}-5,6-dimethylpyrimidin-4-amine |
| Formula | C19H17ClFN3O |
| Mass | 357.809 |
| Exact Mass | 357.1044181 |
| Composition | C (63.78%), H (4.79%), Cl (9.91%), F (5.31%), N (11.74%), O (4.47%) |
| Atom Count | 42 |
| PI | 10.92 |
| Smiles | c1(c(ncnc1Nc1cc(c(cc1)OCc1cc(ccc1)F)Cl)C)C |
| InChI | 1S/C19H17ClFN3O/c1-12-13(2)22-11-23-19(12)24-16-6-7-18(17(20)9-16)25-10-14-4-3-5-15(21)8-14/h3-9,11H
,10H2,1-2H3,(H,22,23,24) |
| InChIKey | QQDKYSNDWYIWJF-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 | 21334203 |
| 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 |
53317173
|
| Drug Bank Link | - |
| ChemSpider Link | 26386538 |
| ChEMBL Link | CHEMBL1683955 |
