Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0003479
Inhibitor ClassAnilino-quinazoline
Molecule Name in Refrence Article18 compound
IUPAC NameN-methyl-N-phenyl-6-[(2E)-3-(pyridin-2-ylmethyl)triaz-2-en-1-yl]quinazolin-4-amine
FormulaC21H19N7
Mass369.4225
Exact Mass369.1701936
Composition C (68.28%), H (5.18%), N (26.54%)
Atom Count47
PI11.59
Smilesc1(c2c(ncn1)ccc(c2)N/N=N/Cc1ncccc1)N(c1ccccc1)C
InChI1S/C21H19N7/c1-28(18-8-3-2-4-9-18)21-19-13-16(10-11-20(19)23-15-24-21)26-27-25-14-17-7-5-6-12-22-17/
h2-13,15H,14H2,1H3,(H,25,26)
InChIKeyJQGXTUPDMJBRGY-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
Reference13678409
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 10926736
Drug Bank Link -
ChemSpider Link 9101981
ChEMBL Link CHEMBL137635
 
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