Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002801
Inhibitor ClassTyrphostin
Molecule Name in Refrence Article17 compound
IUPAC Name2-(4,5-dihydroxy-2,3-dihydro-1H-inden-1-ylidene)propanedinitrile
FormulaC12H8N2O2
Mass212.2041
Exact Mass212.0585775
Composition C (67.92%), H (3.8%), N (13.2%), O (15.08%)
Atom Count24
PINo isoelectric point.
Smilesc1(c(ccc2c1CCC2=C(C#N)C#N)O)O
InChI1S/C12H8N2O2/c13-5-7(6-14)8-1-2-10-9(8)3-4-11(15)12(10)16/h3-4,15-16H,1-2H2
InChIKeyQNMCUDUCYPYEQM-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
Reference1676428
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 5328755
Drug Bank Link -
ChemSpider Link 4485917
ChEMBL Link CHEMBL57300
 
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