Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0001664
Inhibitor ClassTyrphostin
Molecule Name in Refrence Article9 compound
IUPAC Name2-[(3,5-di-tert-butyl-4-hydroxyphenyl)methylidene]propanedinitrile
FormulaC18H22N2O
Mass282.3801
Exact Mass282.1732133
Composition C (76.56%), H (7.85%), N (9.92%), O (5.67%)
Atom Count43
PINo isoelectric point.
Smilesc1(cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)C=C(C#N)C#N
InChI1S/C18H22N2O/c1-17(2,3)14-8-12(7-13(10-19)11-20)9-15(16(14)21)18(4,5)6/h7-9,21H,1-6H3
InChIKeyMZOPWQKISXCCTP-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
Find Similar Compounds
                                   

Reported activity against other enzymesNo activity data against other kinases present in database
Pub Chem Link 5614
Drug Bank Link -
ChemSpider Link 5412
ChEMBL Link CHEMBL78150
 
TOP