| General Property |
| Molceule ID (DB) | EGIN0004643 |
| Inhibitor Class | Pyrimidine |
| Molecule Name in Refrence Article | 10c |
| IUPAC Name | N-{[5-(4-{[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]amino}pyrimidin-5-yl)-1,2-oxazol-3-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 | 9.17 |
| Smiles | c1(c(cncn1)c1onc(CNC(=O)C=C)c1)Nc1ccc(c(c1)Cl)OCc1ccccn1 |
| InChI | 1S/C23H19ClN6O3/c1-2-22(31)27-11-17-10-21(33-30-17)18-12-25-14-28-23(18)29-15-6-7-20(19(24)9-15)32-1
3-16-5-3-4-8-26-16/h2-10,12,14H,1,11,13H2,(H,27,31)(H,25,28,29) |
| InChIKey | IONMHWXODSQZPT-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 |
57342208
|
| Drug Bank Link | - |
| ChemSpider Link | 28521123 |
| ChEMBL Link | - |
