Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0000769
Inhibitor ClassAnilino-quinazoline
Molecule Name in Refrence Article66 compound
IUPAC NameN-(2-bromophenyl)-6,7-dimethoxyquinazolin-4-amine
FormulaC16H14BrN3O2
Mass360.205
Exact Mass359.0269394
Composition C (53.35%), H (3.92%), Br (22.18%), N (11.67%), O (8.88%)
Atom Count36
PI9.88
Smilesc12c(cc(c(c1)OC)OC)ncnc2Nc1c(cccc1)Br
InChI1S/C16H14BrN3O2/c1-21-14-7-10-13(8-15(14)22-2)18-9-19-16(10)20-12-6-4-3-5-11(12)17/h3-9H,1-2H3,(H,18
,19,20)
InChIKeyWNZXENIFRJQCEE-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
Reference8568816
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 5328230
Drug Bank Link -
ChemSpider Link 4485395
ChEMBL Link CHEMBL92174
 
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