General Property |
Molceule ID (DB) | EGIN0002929 |
Inhibitor Class | Dianilino-phthalimide |
Molecule Name in Refrence Article | 6 compound |
IUPAC Name | 5,6-bis[(4-methoxyphenyl)amino]-2,3-dihydro-1H-isoindole-1,3-dione |
Formula | C22H19N3O4 |
Mass | 389.404 |
Exact Mass | 389.1375561 |
Composition | C (67.86%), H (4.92%), N (10.79%), O (16.43%) |
Atom Count | 48 |
PI | 4.38 |
Smiles | N1C(=O)c2c(C1=O)cc(c(c2)Nc1ccc(cc1)OC)Nc1ccc(cc1)OC |
InChI | 1S/C22H19N3O4/c1-28-15-7-3-13(4-8-15)23-19-11-17-18(22(27)25-21(17)26)12-20(19)24-14-5-9-16(29-2)10-
6-14/h3-12,23-24H,1-2H3,(H,25,26,27) |
InChIKey | SNNZHOLVTLIFSO-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 | v-ab1 | PKA | RKC | ALL |
Pub Chem Link |
10318148
|
Drug Bank Link | - |
ChemSpider Link | 8493612 |
ChEMBL Link | CHEMBL7352 |