| General Property |
| Molceule ID (DB) | EGIN0003272 |
| Inhibitor Class | Anthranilamide |
| Molecule Name in Refrence Article | 7 compound |
| IUPAC Name | N-[3-(isoquinolin-4-yl)phenyl]-2-[(pyridin-4-ylmethyl)amino]benzamide |
| Formula | C28H22N4O |
| Mass | 430.5005 |
| Exact Mass | 430.1793613 |
| Composition | C (78.12%), H (5.15%), N (13.01%), O (3.72%) |
| Atom Count | 55 |
| PI | 8.5 |
| Smiles | C(=O)(c1c(NCc2ccncc2)cccc1)Nc1cc(c2c3c(cnc2)cccc3)ccc1 |
| InChI | InChI=1S/C28H22N4O/c33-28(25-10-3-4-11-27(25)31-17-20-12-14-29-15-13-20)32-23-8-5-7-21(16-23)26-19-3
0-18-22-6-1-2-9-24(22)26/h1-16,18-19,31H,17H2,(H,32,33) |
| InChIKey | InChIKey=IGMQBINYIPIDJQ-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 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | c-Abl | CDK1 | c-Kit | c-Met | CSF1R | c-Src | FGFR1 | IGF1R | PDGFR beta | TIE2 | VEGFR1 | VEGFR2 | VEGFR3 | ALL |
| Pub Chem Link |
44368815
|
| Drug Bank Link | - |
| ChemSpider Link | 23224984 |
| ChEMBL Link | CHEMBL347537 |
