| General Property |
| Molceule ID (DB) | EGIN0004609 |
| Inhibitor Class | Pyrimidine |
| Molecule Name in Refrence Article | 19c |
| IUPAC Name | N-({2-[4-amino-6-({3-chloro-4-[(3-fluorophenyl)methoxy]phenyl}amino)pyrimidin-5-yl]-1,3-oxazol-4-yl}methyl)prop-2-enamide |
| Formula | C24H20ClFN6O3 |
| Mass | 494.905 |
| Exact Mass | 494.1269444 |
| Composition | C (58.24%), H (4.07%), Cl (7.16%), F (3.84%), N (16.98%), O (9.7%) |
| Atom Count | 55 |
| PI | 9.68 |
| Smiles | c1(c(c(ncn1)N)c1occ(n1)CNC(=O)C=C)Nc1ccc(c(c1)Cl)OCc1cccc(c1)F |
| InChI | 1S/C24H20ClFN6O3/c1-2-20(33)28-10-17-12-35-24(32-17)21-22(27)29-13-30-23(21)31-16-6-7-19(18(25)9-16)
34-11-14-4-3-5-15(26)8-14/h2-9,12-13H,1,10-11H2,(H,28,33)(H3,27,29,30,31) |
| InChIKey | KENGBVSLKJUYEK-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 | 22372864 |
| 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 |
53357503
|
| Drug Bank Link | - |
| ChemSpider Link | 28519961 |
| ChEMBL Link | - |
