| General Property |
| Molceule ID (DB) | EGIN0002935 |
| Inhibitor Class | Dianilino-phthalimide |
| Molecule Name in Refrence Article | 12 compound |
| IUPAC Name | 5-[(4-methoxyphenyl)amino]-6-(phenylamino)-2,3-dihydro-1H-isoindole-1,3-dione |
| Formula | C21H17N3O3 |
| Mass | 359.378 |
| Exact Mass | 359.1269914 |
| Composition | C (70.18%), H (4.77%), N (11.69%), O (13.36%) |
| Atom Count | 44 |
| PI | 4.21 |
| Smiles | N1C(=O)c2c(C1=O)cc(c(c2)Nc1ccccc1)Nc1ccc(cc1)OC |
| InChI | 1S/C21H17N3O3/c1-27-15-9-7-14(8-10-15)23-19-12-17-16(20(25)24-21(17)26)11-18(19)22-13-5-3-2-4-6-13/h
2-12,22-23H,1H3,(H,24,25,26) |
| InChIKey | LESFPZSUPOHBIP-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 | 8151612 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | c-Src | EGFR | PKA | RKC | v-ab1 | ALL |
| Pub Chem Link |
10043994
|
| Drug Bank Link | - |
| ChemSpider Link | 8219558 |
| ChEMBL Link | CHEMBL8095 |
