Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0005086
Inhibitor ClassCurcumin
Molecule Name in Refrence ArticleI15
IUPAC Name(2E,6E)‐2‐[(3,5‐dimethoxyphenyl)methylidene]‐6‐[(4‐hydroxyphenyl)methylidene]cyclohexan‐1‐one
FormulaC24H27NO3
Mass377.4761
Exact Mass377.199093735
Composition C (76.36%), H (7.21%), N (3.71%), O (12.72%)
Atom Count55
PI-
Smiles[H]C(C1=C([H])C([H])=C(C([H])=C1[H])N(C([H])([H])[H])C([H])([H])[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/C24H27NO3/c1-25(2)21-10-8-17(9-11-21)12-19-6-5-7-20(24(19)26)13-18-14-22(27-3)16-23(15-18)28-4/h8
-16H,5-7H2,1-4H3/b19-12+,20-13+
InChIKeyMTWBBTPEPAYVAA-KVOOEGMKSA-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 71508692
Drug Bank Link -
ChemSpider Link 28670080
ChEMBL Link CHEMBL2178352
 
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