| General Property |
| Molceule ID (DB) | EGIN0003090 |
| Inhibitor Class | Pyrimidine |
| Molecule Name in Refrence Article | 5 compound |
| IUPAC Name | N-{3-chloro-4-[(3-fluorophenyl)methoxy]phenyl}-6-methylpyrimidin-4-amine |
| Formula | C18H15ClFN3O |
| Mass | 343.783 |
| Exact Mass | 343.088768 |
| Composition | C (62.89%), H (4.4%), Cl (10.31%), F (5.53%), N (12.22%), O (4.65%) |
| Atom Count | 39 |
| PI | 10.79 |
| Smiles | c1c(ncnc1Nc1cc(c(cc1)OCc1cc(ccc1)F)Cl)C |
| InChI | 1S/C18H15ClFN3O/c1-12-7-18(22-11-21-12)23-15-5-6-17(16(19)9-15)24-10-13-3-2-4-14(20)8-13/h2-9,11H,10
H2,1H3,(H,21,22,23) |
| InChIKey | UVYILPAEBXSCTR-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 |
53318457
|
| Drug Bank Link | - |
| ChemSpider Link | - |
| ChEMBL Link | CHEMBL1683949 |
