Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0001653
Inhibitor ClassTyrphostin
Molecule Name in Refrence Article25 compound
IUPAC Name2-[(3,4-dihydroxy-5-methylphenyl)methylidene]propanedinitrile
FormulaC11H8N2O2
Mass200.1934
Exact Mass200.0585775
Composition C (66%), H (4.03%), N (13.99%), O (15.98%)
Atom Count23
PINo isoelectric point.
Smilesc1(cc(c(c(c1)O)O)C)C=C(C#N)C#N
InChI1S/C11H8N2O2/c1-7-2-8(3-9(5-12)6-13)4-10(14)11(7)15/h2-4,14-15H,1H3
InChIKeyNBBJLHJHLMMMKM-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
Reference7902440
Compounds from ReferenceOther compounds from reference
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Reported activity against other enzymesNo activity data against other kinases present in database
Pub Chem Link 9899125
Drug Bank Link -
ChemSpider Link 8074782
ChEMBL Link CHEMBL116423
 
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