| General Property |
| Molceule ID (DB) | EGIN0000223 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 19 compound |
| IUPAC Name | N-{4-[(3-chloro-4-fluorophenyl)amino]-7-[2-(4-hydroxybutoxy)ethoxy]quinazolin-6-yl}prop-2-enamide |
| Formula | C23H24ClFN4O4 |
| Mass | 474.912 |
| Exact Mass | 474.1470112 |
| Composition | C (58.17%), H (5.09%), Cl (7.47%), F (4%), N (11.8%), O (13.48%) |
| Atom Count | 57 |
| PI | 8.48 |
| Smiles | c12c(ncnc2cc(c(c1)NC(=O)C=C)OCCOCCCCO)Nc1cc(c(cc1)F)Cl |
| InChI | 1S/C23H24ClFN4O4/c1-2-22(31)29-20-12-16-19(13-21(20)33-10-9-32-8-4-3-7-30)26-14-27-23(16)28-15-5-6-1
8(25)17(24)11-15/h2,5-6,11-14,30H,1,3-4,7-10H2,(H,29,31)(H,26,27,28) |
| InChIKey | HVRIYPDAXABTLC-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 | 10753475 |
| 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 | 23126905 |
| ChEMBL Link | CHEMBL32079 |
