| General Property |
| Molceule ID (DB) | EGIN0001896 |
| Inhibitor Class | Anilino-quinoline |
| Molecule Name in Refrence Article | 20 compound |
| IUPAC Name | (2E)-4-(dimethylamino)-N-(4-{[3,6-dioxo-4-(pyridin-2-ylmethoxy)cyclohexa-1,4-dien-1-yl]amino}-7-ethoxyquinazolin-6-yl)but-2-enamide |
| Formula | C28H28N6O5 |
| Mass | 528.5591 |
| Exact Mass | 528.212118 |
| Composition | C (63.63%), H (5.34%), N (15.9%), O (15.13%) |
| Atom Count | 67 |
| PI | 9.37 |
| Smiles | c1(c(cc2c(c1)c(ncn2)NC1=CC(=O)C(=CC1=O)OCc1ncccc1)OCC)NC(=O)/C=C/CN(C)C |
| InChI | 1S/C28H28N6O5/c1-4-38-25-14-20-19(12-22(25)32-27(37)9-7-11-34(2)3)28(31-17-30-20)33-21-13-24(36)26(1
5-23(21)35)39-16-18-8-5-6-10-29-18/h5-10,12-15,17H,4,11,16H2,1-3H3,(H,32,37)(H,30,31,33)/b9-7+ |
| InChIKey | QVVKYQOIYUSEGU-VQHVLOKHSA-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 | 17416531 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | VEGFR2 | VEGFR2 | ALL |
| Pub Chem Link |
44428891
|
| Drug Bank Link | - |
| ChemSpider Link | 23290742 |
| ChEMBL Link | CHEMBL398154 |
