| General Property |
| Molceule ID (DB) | EGIN0003071 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 7a compound |
| IUPAC Name | 6-(buta-2,3-dien-1-yloxy)-4-[(3-chlorophenyl)amino]quinazolin-7-ol |
| Formula | C18H14ClN3O2 |
| Mass | 339.776 |
| Exact Mass | 339.0774544 |
| Composition | C (63.63%), H (4.15%), Cl (10.43%), N (12.37%), O (9.42%) |
| Atom Count | 38 |
| PI | 6.54 |
| Smiles | c1(c(cc2c(c1)c(ncn2)Nc1cc(ccc1)Cl)O)OCC=C=C |
| InChI | 1S/C18H14ClN3O2/c1-2-3-7-24-17-9-14-15(10-16(17)23)20-11-21-18(14)22-13-6-4-5-12(19)8-13/h3-6,8-11,2
3H,1,7H2,(H,20,21,22) |
| InChIKey | HPCAJGIOGMEMOW-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 | 19969465 |
| 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 |
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| Drug Bank Link | - |
| ChemSpider Link | 24656674 |
| ChEMBL Link | CHEMBL609321 |
