| General Property |
| Molceule ID (DB) | EGIN0001841 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 4 compound |
| IUPAC Name | 6,7-dimethoxy-N-[3-methyl-4-(pyridin-2-ylmethoxy)phenyl]quinazolin-4-amine |
| Formula | C23H22N4O3 |
| Mass | 402.4458 |
| Exact Mass | 402.1691906 |
| Composition | C (68.64%), H (5.51%), N (13.92%), O (11.93%) |
| Atom Count | 52 |
| PI | 10.8 |
| Smiles | c12c(ncnc1cc(c(c2)OC)OC)Nc1cc(c(OCc2ncccc2)cc1)C |
| InChI | 1S/C23H22N4O3/c1-15-10-16(7-8-20(15)30-13-17-6-4-5-9-24-17)27-23-18-11-21(28-2)22(29-3)12-19(18)25-1
4-26-23/h4-12,14H,13H2,1-3H3,(H,25,26,27) |
| InChIKey | NDHNEUUBLJKLCP-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 | 16055332 |
| 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 |
18967573
|
| Drug Bank Link | - |
| ChemSpider Link | 13910643 |
| ChEMBL Link | CHEMBL371888 |
