Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002795
Inhibitor ClassTyrphostin
Molecule Name in Refrence Article11 compound
IUPAC Name2-(1H-pyrazol-5-ylmethylidene)propanedinitrile
FormulaC7H4N4
Mass144.1335
Exact Mass144.0435961
Composition C (58.33%), H (2.8%), N (38.87%)
Atom Count15
PI7.67
SmilesC(=C(C#N)C#N)c1ccn[nH]1
InChI1S/C7H4N4/c8-4-6(5-9)3-7-1-2-10-11-7/h1-3H,(H,10,11)
InChIKeyUBHAOBPYJHLFBZ-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
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Reported activity against other enzymesNo activity data against other kinases present in database
Pub Chem Link 5328749
Drug Bank Link -
ChemSpider Link 4485911
ChEMBL Link CHEMBL298810
 
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