Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002931
Inhibitor ClassDianilino-phthalimide
Molecule Name in Refrence Article8 compound
IUPAC Name5,6-bis({[4-(diethylamino)phenyl]amino})-2,3-dihydro-1H-isoindole-1,3-dione
FormulaC28H33N5O2
Mass471.5939
Exact Mass471.2634253
Composition C (71.31%), H (7.05%), N (14.85%), O (6.79%)
Atom Count68
PI8.06
SmilesN1C(=O)c2c(C1=O)cc(c(c2)Nc1ccc(N(CC)CC)cc1)Nc1ccc(N(CC)CC)cc1
InChI1S/C28H33N5O2/c1-5-32(6-2)21-13-9-19(10-14-21)29-25-17-23-24(28(35)31-27(23)34)18-26(25)30-20-11-15-
22(16-12-20)33(7-3)8-4/h9-18,29-30H,5-8H2,1-4H3,(H,31,34,35)
InChIKeyZIUKVZLABPRJTA-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
Reference8151612
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesc-Src | v-ab1 | PKA | RKC | EGFR | ALL
Pub Chem Link 10434923
Drug Bank Link -
ChemSpider Link 8610349
ChEMBL Link CHEMBL8223
 
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