| General Property |
| Molceule ID (DB) | EGIN0004601 |
| Inhibitor Class | Pyrimidine |
| Molecule Name in Refrence Article | 19k |
| IUPAC Name | N-{[2-(4-amino-6-{[3-chloro-4-(3-fluorophenoxy)phenyl]amino}pyrimidin-5-yl)-1,3-oxazol-4-yl]methyl}prop-2-enamide |
| Formula | C23H18ClFN6O3 |
| Mass | 480.879 |
| Exact Mass | 480.1112944 |
| Composition | C (57.45%), H (3.77%), Cl (7.37%), F (3.95%), N (17.48%), O (9.98%) |
| Atom Count | 52 |
| PI | 9.62 |
| Smiles | c1(c(c(ncn1)N)c1occ(n1)CNC(=O)C=C)Nc1ccc(c(c1)Cl)Oc1cc(ccc1)F |
| InChI | 1S/C23H18ClFN6O3/c1-2-19(32)27-10-15-11-33-23(31-15)20-21(26)28-12-29-22(20)30-14-6-7-18(17(24)9-14)
34-16-5-3-4-13(25)8-16/h2-9,11-12H,1,10H2,(H,27,32)(H3,26,28,29,30) |
| InChIKey | CKQCOTRLYJGUDA-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 |
53357628
|
| Drug Bank Link | - |
| ChemSpider Link | 28521168 |
| ChEMBL Link | - |
