| General Property |
| Molceule ID (DB) | EGIN0003950 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 13 compound |
| IUPAC Name | N-(4-chloro-2-fluorophenyl)-6-methoxy-7-{2-[methyl(pyridin-4-yl)amino]ethoxy}quinazolin-4-amine |
| Formula | C23H21ClFN5O2 |
| Mass | 453.897 |
| Exact Mass | 453.1367809 |
| Composition | C (60.86%), H (4.66%), Cl (7.81%), F (4.19%), N (15.43%), O (7.05%) |
| Atom Count | 53 |
| PI | 11.22 |
| Smiles | c12c(Nc3c(cc(cc3)Cl)F)ncnc1cc(c(c2)OC)OCCN(c1ccncc1)C |
| InChI | 1S/C23H21ClFN5O2/c1-30(16-5-7-26-8-6-16)9-10-32-22-13-20-17(12-21(22)31-2)23(28-14-27-20)29-19-4-3-1
5(24)11-18(19)25/h3-8,11-14H,9-10H2,1-2H3,(H,27,28,29) |
| InChIKey | HTZZYCNEQVCJJB-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 | 11881999 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | Flt1 | FGFR | KDR | ALL |
| Pub Chem Link |
5329026
|
| Drug Bank Link | - |
| ChemSpider Link | 4486188 |
| ChEMBL Link | CHEMBL25579 |
