General Property |
Molceule ID (DB) | EGIN0002936 |
Inhibitor Class | Dianilino-phthalimide |
Molecule Name in Refrence Article | 13 compound |
IUPAC Name | 1,4-diphenyl-1H,2H,3H,4H,6H,7H,8H-pyrrolo[3,4-g]quinoxaline-6,8-dione |
Formula | C22H17N3O2 |
Mass | 355.3893 |
Exact Mass | 355.1320768 |
Composition | C (74.35%), H (4.82%), N (11.82%), O (9%) |
Atom Count | 44 |
PI | 3.11 |
Smiles | c12c(N(CCN1c1ccccc1)c1ccccc1)cc1C(=O)NC(=O)c1c2 |
InChI | 1S/C22H17N3O2/c26-21-17-13-19-20(14-18(17)22(27)23-21)25(16-9-5-2-6-10-16)12-11-24(19)15-7-3-1-4-8-1
5/h1-10,13-14H,11-12H2,(H,23,26,27) |
InChIKey | DNRPTTQOSZQOGJ-UHFFFAOYSA-N |
2D Structure | | Structure Backbone | |
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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 | EGFR | c-Src | v-ab1 | PKA | RKC | ALL |
Pub Chem Link |
10450849
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Drug Bank Link | - |
ChemSpider Link | 8626266 |
ChEMBL Link | CHEMBL266255 |