| General Property |
| Molceule ID (DB) | EGIN0002930 |
| Inhibitor Class | Dianilino-phthalimide |
| Molecule Name in Refrence Article | 7 compound |
| IUPAC Name | 5,6-bis[(4-hydroxyphenyl)amino]-2,3-dihydro-1H-isoindole-1,3-dione |
| Formula | C20H15N3O4 |
| Mass | 361.3508 |
| Exact Mass | 361.106256 |
| Composition | C (66.48%), H (4.18%), N (11.63%), O (17.71%) |
| Atom Count | 42 |
| PI | 4.49 |
| Smiles | N1C(=O)c2c(C1=O)cc(c(c2)Nc1ccc(cc1)O)Nc1ccc(cc1)O |
| InChI | 1S/C20H15N3O4/c24-13-5-1-11(2-6-13)21-17-9-15-16(20(27)23-19(15)26)10-18(17)22-12-3-7-14(25)8-4-12/h
1-10,21-22,24-25H,(H,23,26,27) |
| InChIKey | TYLKNORJFZPIPX-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 | PKA | v-ab1 | EGFR | RKC | c-Src | ALL |
| Pub Chem Link |
10406267
|
| Drug Bank Link | - |
| ChemSpider Link | 8581705 |
| ChEMBL Link | CHEMBL267019 |
