| General Property |
| Molceule ID (DB) | EGIN0004780 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 13 |
| IUPAC Name | N-{4-[(3-chloro-4-fluorophenyl)amino]-7-ethoxyquinazolin-6-yl}-3-(morpholin-4-yl)propanamide |
| Formula | C23H25ClFN5O3 |
| Mass | 473.928 |
| Exact Mass | 473.1629956 |
| Composition | C (58.29%), H (5.32%), Cl (7.48%), F (4.01%), N (14.78%), O (10.13%) |
| Atom Count | 58 |
| PI | 9.55 |
| Smiles | c1c(c(cc2c1c(ncn2)Nc1ccc(c(c1)Cl)F)OCC)NC(=O)CCN1CCOCC1 |
| InChI | 1S/C23H25ClFN5O3/c1-2-33-21-13-19-16(12-20(21)29-22(31)5-6-30-7-9-32-10-8-30)23(27-14-26-19)28-15-3-
4-18(25)17(24)11-15/h3-4,11-14H,2,5-10H2,1H3,(H,29,31)(H,26,27,28) |
| InChIKey | WHNBMDXDKOQHCS-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 | 22280453 |
| 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 |
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| Drug Bank Link | - |
| ChemSpider Link | 28511386 |
| ChEMBL Link | - |
