| General Property |
| Molceule ID (DB) | EGIN0004753 |
| Inhibitor Class | Anilino-quinazoline |
| Molecule Name in Refrence Article | 16 |
| IUPAC Name | 6-N-(2H-1,3-benzodioxol-5-ylmethyl)-4-N-(3-chlorophenyl)quinazoline-4,6-diamine |
| Formula | C22H17ClN4O2 |
| Mass | 404.849 |
| Exact Mass | 404.1040035 |
| Composition | C (65.27%), H (4.23%), Cl (8.76%), N (13.84%), O (7.9%) |
| Atom Count | 46 |
| PI | 10.48 |
| Smiles | c1c2OCOc2cc(c1)CNc1cc2c(cc1)ncnc2Nc1cccc(c1)Cl |
| InChI | 1S/C22H17ClN4O2/c23-15-2-1-3-17(9-15)27-22-18-10-16(5-6-19(18)25-12-26-22)24-11-14-4-7-20-21(8-14)29
-13-28-20/h1-10,12,24H,11,13H2,(H,25,26,27) |
| InChIKey | CVXGWPCZIJNFAQ-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 | 22901387 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | VEGFR2 | |
| Pub Chem Link |
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| Drug Bank Link | - |
| ChemSpider Link | 28514147 |
| ChEMBL Link | - |
