Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002819
Inhibitor ClassCinnamide
Molecule Name in Refrence Article1
IUPAC Name(2E)-2-cyano-3-(3,4-dihydroxyphenyl)-N-phenylprop-2-enamide
FormulaC16H12N2O3
Mass280.2781
Exact Mass280.0847923
Composition C (68.56%), H (4.32%), N (9.99%), O (17.13%)
Atom Count33
PI2.71
SmilesN(C(=O)/C(=C/c1cc(c(cc1)O)O)/C#N)c1ccccc1
InChI1S/C16H12N2O3/c17-10-12(8-11-6-7-14(19)15(20)9-11)16(21)18-13-4-2-1-3-5-13/h1-9,19-20H,(H,18,21)/b12
-8+
InChIKeyHKHOVJYOELRGMV-XYOKQWHBSA-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
Reference8667360 | 1676428 | 10464027 |
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesNo activity data against other kinases present in database
Pub Chem Link 5328771
Drug Bank Link -
ChemSpider Link 4485933
ChEMBL Link CHEMBL56731
 
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