| General Property |
| Molceule ID (DB) | EGIN0001900 |
| Inhibitor Class | Anilino-quinoline |
| Molecule Name in Refrence Article | 24 compound |
| IUPAC Name | (2E)-4-(dimethylamino)-N-[7-ethoxy-4-({4-[(3-methylphenyl)methoxy]-3,6-dioxocyclohexa-1,4-dien-1-yl}amino)quinazolin-6-yl]but-2-enamide |
| Formula | C30H31N5O5 |
| Mass | 541.5976 |
| Exact Mass | 541.2325191 |
| Composition | C (66.53%), H (5.77%), N (12.93%), O (14.77%) |
| Atom Count | 71 |
| PI | 9.37 |
| Smiles | c1(c(cc2c(c1)c(ncn2)NC1=CC(=O)C(=CC1=O)OCc1cc(ccc1)C)OCC)NC(=O)/C=C/CN(C)C |
| InChI | 1S/C30H31N5O5/c1-5-39-27-15-22-21(13-24(27)33-29(38)10-7-11-35(3)4)30(32-18-31-22)34-23-14-26(37)28(
16-25(23)36)40-17-20-9-6-8-19(2)12-20/h6-10,12-16,18H,5,11,17H2,1-4H3,(H,33,38)(H,31,32,34)/b10-7+ |
| InChIKey | FWQHTPQAWDKGBW-JXMROGBWSA-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 |
44428899
|
| Drug Bank Link | - |
| ChemSpider Link | 23290751 |
| ChEMBL Link | CHEMBL241919 |
