Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0004855
Inhibitor ClassAnilino-quinazoline
Molecule Name in Refrence Article5
IUPAC Name1-N-(6,7-dimethoxyquinazolin-4-yl)benzene-1,4-diamine
FormulaC16H16N4O2
Mass296.3238
Exact Mass296.1273258
Composition C (64.85%), H (5.44%), N (18.91%), O (10.8%)
Atom Count38
PI11.48
SmilesCOc1c(OC)cc2c(Nc3ccc(cc3)N)ncnc2c1
InChI1S/C16H16N4O2/c1-21-14-7-12-13(8-15(14)22-2)18-9-19-16(12)20-11-5-3-10(17)4-6-11/h3-9H,17H2,1-2H3,(H
,18,19,20)
InChIKeyFCQHLBNBKHUZIB-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
Reference22867529
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesNo activity data against other kinases present in database
Pub Chem Link 19963206
Drug Bank Link -
ChemSpider Link -
ChEMBL Link -
 
TOP