| General Property |
| Molceule ID (DB) | EGIN0003946 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 9 compound |
| IUPAC Name | N-(4-chloro-2-fluorophenyl)-6-methoxy-7-[3-(pyrrolidin-1-yl)propoxy]quinazolin-4-amine |
| Formula | C22H24ClFN4O2 |
| Mass | 430.903 |
| Exact Mass | 430.1571819 |
| Composition | C (61.32%), H (5.61%), Cl (8.23%), F (4.41%), N (13%), O (7.43%) |
| Atom Count | 54 |
| PI | 11.45 |
| Smiles | c12c(Nc3c(cc(cc3)Cl)F)ncnc1cc(c(c2)OC)OCCCN1CCCC1 |
| InChI | 1S/C22H24ClFN4O2/c1-29-20-12-16-19(13-21(20)30-10-4-9-28-7-2-3-8-28)25-14-26-22(16)27-18-6-5-15(23)1
1-17(18)24/h5-6,11-14H,2-4,7-10H2,1H3,(H,25,26,27) |
| InChIKey | KQVFLNYZDGJFNM-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 |
5329037
|
| Drug Bank Link | - |
| ChemSpider Link | 4486199 |
| ChEMBL Link | CHEMBL24133 |
