Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002926
Inhibitor ClassDianilino-phthalimide
Molecule Name in Refrence ArticleDAPH
IUPAC Name5,6-bis(phenylamino)-2,3-dihydro-1H-isoindole-1,3-dione
FormulaC20H15N3O2
Mass329.352
Exact Mass329.1164267
Composition C (72.94%), H (4.59%), N (12.76%), O (9.72%)
Atom Count40
PI3.85
Smilesc1cccc(c1)Nc1c(cc2c(c1)C(=O)NC2=O)Nc1ccccc1
InChI1S/C20H15N3O2/c24-19-15-11-17(21-13-7-3-1-4-8-13)18(12-16(15)20(25)23-19)22-14-9-5-2-6-10-14/h1-12,2
1-22H,(H,23,24,25)
InChIKeyAAALVYBICLMAMA-UHFFFAOYSA-N
2D Structure
Structure Backbone
View Structure in JmolClick to view 3 d structure                            Download Mol File
Drug Like PropertyDruglikeliness
Symmetry & GeometrySymmetry And Geometrical Information
Activity & Binding Activity against isoform and covalant binding information
Topological PropertiesDescriptors
Reference8134396 | 8151612 | 16279804 |
Compounds from ReferenceOther compounds from reference
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Reported activity against other enzymesv-ab1 | PKA | c-Src | EGFR | RKC | ALL
Pub Chem Link 1697
Drug Bank Link -
ChemSpider Link 1634
ChEMBL Link CHEMBL268868
 
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