| General Property |
| Molceule ID (DB) | EGIN0004685 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 25 |
| IUPAC Name | N-(3-chloro-4-fluorophenyl)-6-[2-(diethylamino)ethoxy]-7-methoxyquinazolin-4-amine |
| Formula | C21H24ClFN4O2 |
| Mass | 418.892 |
| Exact Mass | 418.1571819 |
| Composition | C (60.21%), H (5.77%), Cl (8.46%), F (4.54%), N (13.37%), O (7.64%) |
| Atom Count | 53 |
| PI | 12.65 |
| Smiles | c1c(c(cc2c1c(ncn2)Nc1ccc(c(c1)Cl)F)OC)OCCN(CC)CC |
| InChI | 1S/C21H24ClFN4O2/c1-4-27(5-2)8-9-29-20-11-15-18(12-19(20)28-3)24-13-25-21(15)26-14-6-7-17(23)16(22)1
0-14/h6-7,10-13H,4-5,8-9H2,1-3H3,(H,24,25,26) |
| InChIKey | OOSIXUJCRGYBQJ-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 | 11459659 |
| 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 |
19077513
|
| Drug Bank Link | - |
| ChemSpider Link | 13940744 |
| ChEMBL Link | CHEMBL293064 |
