| General Property |
| Molceule ID (DB) | EGIN0001196 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 24 compound |
| IUPAC Name | N-{4-[(3-chloro-4-fluorophenyl)methyl]-7-(2-methoxyethoxy)pyrido[3,2-d]pyrimidin-6-yl}prop-2-enamide |
| Formula | C20H18ClFN4O3 |
| Mass | 416.833 |
| Exact Mass | 416.1051464 |
| Composition | C (57.63%), H (4.35%), Cl (8.51%), F (4.56%), N (13.44%), O (11.51%) |
| Atom Count | 47 |
| PI | 7.02 |
| Smiles | c12nc(c(cc1ncnc2Cc1cc(c(cc1)F)Cl)OCCOC)NC(=O)C=C |
| InChI | 1S/C20H18ClFN4O3/c1-3-18(27)25-20-17(29-7-6-28-2)10-16-19(26-20)15(23-11-24-16)9-12-4-5-14(22)13(21)
8-12/h3-5,8,10-11H,1,6-7,9H2,2H3,(H,25,26,27) |
| InChIKey | FPKZEOVCLPUZDO-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 | 10956451 |
| 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 |
44564530
|
| Drug Bank Link | - |
| ChemSpider Link | 23335383 |
| ChEMBL Link | CHEMBL490498 |
