Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0005072
Inhibitor ClassCurcumin
Molecule Name in Refrence ArticleI1
IUPAC Name(2E,6E)-2-Benzylidene-6-(3,5-dimethoxybenzylidene)-cyclohexanone
FormulaC22H22O3
Mass334.4083
Exact Mass334.15689457
Composition C (79.02%), H (6.63%), O (14.35%)
Atom Count47
PI-
Smiles[H]C(C1=C([H])C([H])=C([H])C([H])=C1[H])=C1/C(=O)/C(=C([H])C2=C([H])C(OC([H])([H])[H])=C([H])C(OC([H])([H])[H])=C2[H])C([H])([H])C([H])([H])C1([H])[H]
InChI1S/C22H22O3/c1-24-20-13-17(14-21(15-20)25-2)12-19-10-6-9-18(22(19)23)11-16-7-4-3-5-8-16/h3-5,7-8,11-
15H,6,9-10H2,1-2H3/b18-11+,19-12+
InChIKey LQVXXMBNQOFZDU-GDAWTGGTSA-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
Reference23245570
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 71508607
Drug Bank Link -
ChemSpider Link 29395401
ChEMBL Link CHEMBL2316147
 
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