Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0001718
Inhibitor ClassTyrphostin
Molecule Name in Refrence Article63 compound
IUPAC Name2-[(4-hydroxyphenyl)methyl]propanedinitrile
FormulaC10H8N2O
Mass172.1833
Exact Mass172.0636629
Composition C (69.76%), H (4.68%), N (16.27%), O (9.29%)
Atom Count21
PINo isoelectric point.
Smilesc1(ccc(cc1)O)CC(C#N)C#N
InChI1S/C10H8N2O/c11-6-9(7-12)5-8-1-3-10(13)4-2-8/h1-4,9,13H,5H2
InChIKeyPDRLQWJJFLVIRC-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
Reference2552117
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 5613
Drug Bank Link -
ChemSpider Link 5411
ChEMBL Link CHEMBL76587
 
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