| General Property |
| Molceule ID (DB) | EGIN0004606 |
| Inhibitor Class | Pyrimidine |
| Molecule Name in Refrence Article | 19f |
| IUPAC Name | N-[(2-{4-amino-6-[(3-chloro-4-phenoxyphenyl)amino]pyrimidin-5-yl}-1,3-oxazol-4-yl)methyl]prop-2-enamide |
| Formula | C23H19ClN6O3 |
| Mass | 462.888 |
| Exact Mass | 462.1207162 |
| Composition | C (59.68%), H (4.14%), Cl (7.66%), N (18.16%), O (10.37%) |
| Atom Count | 52 |
| PI | 9.62 |
| Smiles | c1(c(c(ncn1)N)c1occ(n1)CNC(=O)C=C)Nc1ccc(c(c1)Cl)Oc1ccccc1 |
| InChI | 1S/C23H19ClN6O3/c1-2-19(31)26-11-15-12-32-23(30-15)20-21(25)27-13-28-22(20)29-14-8-9-18(17(24)10-14)
33-16-6-4-3-5-7-16/h2-10,12-13H,1,11H2,(H,26,31)(H3,25,27,28,29) |
| InChIKey | LDWZMBYMXRSWTO-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 |
57342369
|
| Drug Bank Link | - |
| ChemSpider Link | 28508221 |
| ChEMBL Link | - |
