Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0000960
Inhibitor ClassAnilino-quinazoline
Molecule Name in Refrence Article40 compound
IUPAC NameN-benzyl-6,7-dimethoxyquinazolin-4-amine
FormulaC17H17N3O2
Mass295.3358
Exact Mass295.1320768
Composition C (69.14%), H (5.8%), N (14.23%), O (10.83%)
Atom Count39
PI12.32
Smilesc12c(cc(c(c1)OC)OC)ncnc2NCc1ccccc1
InChI1S/C17H17N3O2/c1-21-15-8-13-14(9-16(15)22-2)19-11-20-17(13)18-10-12-6-4-3-5-7-12/h3-9,11H,10H2,1-2H3
,(H,18,19,20)
InChIKeyFVWVAEZYXLGVIV-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 1474877
Drug Bank Link -
ChemSpider Link 1216703
ChEMBL Link CHEMBL325245
 
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