Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0000926
Inhibitor ClassAnilino-quinazoline
Molecule Name in Refrence Article6 compound
IUPAC NameN-(2-phenylethyl)quinazolin-4-amine
FormulaC16H15N3
Mass249.3104
Exact Mass249.1265975
Composition C (77.08%), H (6.06%), N (16.85%)
Atom Count34
PI12.54
Smilesc12c(cccc1)ncnc2NCCc1ccccc1
InChI1S/C16H15N3/c1-2-6-13(7-3-1)10-11-17-16-14-8-4-5-9-15(14)18-12-19-16/h1-9,12H,10-11H2,(H,17,18,19)
InChIKeyYKOSADJQCBRMRR-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
Reference7658435
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 198909
Drug Bank Link -
ChemSpider Link 172166
ChEMBL Link CHEMBL117804
 
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