| General Property |
| Molceule ID (DB) | EGIN0001530 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 6d compound |
| IUPAC Name | 3-{3-[(6,7-dimethoxyquinazolin-4-yl)amino]phenyl}prop-2-yn-1-ol |
| Formula | C19H17N3O3 |
| Mass | 335.3566 |
| Exact Mass | 335.1269914 |
| Composition | C (68.05%), H (5.11%), N (12.53%), O (14.31%) |
| Atom Count | 42 |
| PI | 9.35 |
| Smiles | c12c(cc(c(c1)OC)OC)ncnc2Nc1cccc(c1)C#CCO |
| InChI | 1S/C19H17N3O3/c1-24-17-10-15-16(11-18(17)25-2)20-12-21-19(15)22-14-7-3-5-13(9-14)6-4-8-23/h3,5,7,9-1
2,23H,8H2,1-2H3,(H,20,21,22) |
| InChIKey | WIBRRSMFZMVFSE-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 | 17889528 |
| 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 |
15520888
|
| Drug Bank Link | - |
| ChemSpider Link | 13078128 |
| ChEMBL Link | CHEMBL399736 |
