General Property |
Molceule ID (DB) | EGIN0004929 |
Inhibitor Class | Dianilino-phthalimide |
Molecule Name in Refrence Article | Metabolite 1 (M1) |
IUPAC Name | 5-[(4-hydroxyphenyl)amino]-6-(phenylamino)-2,3-dihydro-1H-isoindole-1,3-dione |
Formula | C20H15N3O3 |
Mass | 345.3514 |
Exact Mass | 345.1113414 |
Composition | C (69.56%), H (4.38%), N (12.17%), O (13.9%) |
Atom Count | 41 |
PI | 4.37 |
Smiles | c1(c(Nc2ccccc2)cc2c(c1)C(=O)NC2=O)Nc1ccc(cc1)O |
InChI | 1S/C20H15N3O3/c24-14-8-6-13(7-9-14)22-18-11-16-15(19(25)23-20(16)26)10-17(18)21-12-4-2-1-3-5-12/h1-1
1,21-22,24H,(H,23,25,26) |
InChIKey | AGGVZVIQMNSAPN-UHFFFAOYSA-N |
2D Structure | ![](./image/EGIN0004929.png) | Structure Backbone | ![](./frame/f_EGIN0004929.png) |
|
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 | 9816050 |
Compounds from Reference | Other compounds from reference |
Find Similar Compounds | |
Reported activity against other enzymes | v-abl kinase | c-src kinase | Cyclic AMP-dependent protein kinase | Phosphorylase kinase | PKC alpha | PKC beta-1 | PKC beta-2 | PKC gamma | PKC delta | PKC epsilon | PK zeta | PKC eata | ALL |
Pub Chem Link |
22918354
|
Drug Bank Link | - |
ChemSpider Link | - |
ChEMBL Link | - |