| General Property |
| Molceule ID (DB) | EGIN0001904 |
| Inhibitor Class | Anilino-quinoline |
| Molecule Name in Refrence Article | Vatalanib |
| IUPAC Name | N-(4-chlorophenyl)-4-(pyridin-4-ylmethyl)phthalazin-1-amine |
| Formula | C20H15ClN4 |
| Mass | 346.813 |
| Exact Mass | 346.0985242 |
| Composition | C (69.26%), H (4.36%), Cl (10.22%), N (16.15%) |
| Atom Count | 40 |
| PI | 10.05 |
| Smiles | c12cc(c(cc1ncc(c2N[C@@H]1[C@H](C1)c1c(cccc1)F)C#C)OC)OC |
| InChI | 1S/C20H15ClN4/c21-15-5-7-16(8-6-15)23-20-18-4-2-1-3-17(18)19(24-25-20)13-14-9-11-22-12-10-14/h1-12H,
13H2,(H,23,25) |
| InChIKey | YCOYDOIWSSHVCK-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 | 12477352 | 12941313 | 17416531 | |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | VEGFR2 | VEGFR2 | ALL |
| Pub Chem Link |
151194
|
| Drug Bank Link | - |
| ChemSpider Link | - |
| ChEMBL Link | CHEMBL101253 |
