Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002791
Inhibitor ClassIndole
Molecule Name in Refrence ArticleAG370
IUPAC Name(3Z)-2-amino-3-(1H-indol-5-ylmethylidene)prop-1-ene-1,1,3-tricarbonitrile
FormulaC15H9N5
Mass259.2655
Exact Mass259.0857953
Composition C (69.49%), H (3.5%), N (27.01%)
Atom Count29
PI5.87
SmilesC(=Cc1cc2c([nH]cc2)cc1)(/C(=C(C#N)C#N)N)C#N
InChI1S/C15H9N5/c16-7-12(15(19)13(8-17)9-18)6-10-1-2-14-11(5-10)3-4-20-14/h1-6,20H,19H2/b12-6+
InChIKeyCMMDWEJTQUTCKG-WUXMJOGZSA-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
Reference8960549 | 8667360 | 1676428 |
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 -
Drug Bank Link -
ChemSpider Link 20120313
ChEMBL Link CHEMBL59150
 
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