| General Property |
| Molceule ID (DB) | EGIN0000737 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 34 compound |
| IUPAC Name | 6,7-dimethoxy-N-[3-(trifluoromethyl)phenyl]quinazolin-4-amine |
| Formula | C17H14F3N3O2 |
| Mass | 349.3072 |
| Exact Mass | 349.1038113 |
| Composition | C (58.45%), H (4.04%), F (16.32%), N (12.03%), O (9.16%) |
| Atom Count | 39 |
| PI | 10.3 |
| Smiles | c12c(cc(c(c1)OC)OC)ncnc2Nc1cccc(c1)C(F)(F)F |
| InChI | 1S/C17H14F3N3O2/c1-24-14-7-12-13(8-15(14)25-2)21-9-22-16(12)23-11-5-3-4-10(6-11)17(18,19)20/h3-9H,1-
2H3,(H,21,22,23) |
| InChIKey | KEQCEKUDWPXRRQ-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 | 8568816 |
| 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 |
5328202
|
| Drug Bank Link | - |
| ChemSpider Link | 4485367 |
| ChEMBL Link | CHEMBL316064 |
