| General Property |
| Molceule ID (DB) | EGIN0004061 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 16b compound |
| IUPAC Name | 6,7-diethoxy-N-(4-fluorophenyl)quinazolin-4-amine |
| Formula | C18H18FN3O2 |
| Mass | 327.3528 |
| Exact Mass | 327.138305 |
| Composition | C (66.04%), H (5.54%), F (5.8%), N (12.84%), O (9.78%) |
| Atom Count | 42 |
| PI | 10.52 |
| Smiles | c1(c(cc2c(c1)c(ncn2)Nc1ccc(cc1)F)OCC)OCC |
| InChI | 1S/C18H18FN3O2/c1-3-23-16-9-14-15(10-17(16)24-4-2)20-11-21-18(14)22-13-7-5-12(19)6-8-13/h5-11H,3-4H2
,1-2H3,(H,20,21,22) |
| InChIKey | RXOKOKWXZNENPQ-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 | 16279804 |
| 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 |
11552307
|
| Drug Bank Link | - |
| ChemSpider Link | 9727085 |
| ChEMBL Link | CHEMBL225324 |
