| General Property |
| Molceule ID (DB) | EGIN0003957 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 21 compound |
| IUPAC Name | N-(4-chloro-2-fluorophenyl)-6-methoxy-7-(piperidin-4-ylmethoxy)quinazolin-4-amine |
| Formula | C21H22ClFN4O2 |
| Mass | 416.876 |
| Exact Mass | 416.1415319 |
| Composition | C (60.5%), H (5.32%), Cl (8.5%), F (4.56%), N (13.44%), O (7.68%) |
| Atom Count | 51 |
| PI | 12.03 |
| Smiles | c12c(Nc3c(cc(cc3)Cl)F)ncnc1cc(c(c2)OC)OCC1CCNCC1 |
| InChI | 1S/C21H22ClFN4O2/c1-28-19-9-15-18(10-20(19)29-11-13-4-6-24-7-5-13)25-12-26-21(15)27-17-3-2-14(22)8-1
6(17)23/h2-3,8-10,12-13,24H,4-7,11H2,1H3,(H,25,26,27) |
| InChIKey | AVQNSHZBOYOSQZ-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 | KDR | FGFR | ALL |
| Pub Chem Link |
5329047
|
| Drug Bank Link | - |
| ChemSpider Link | 4486209 |
| ChEMBL Link | CHEMBL26456 |
