Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0004049
Inhibitor ClassAnilino-quinazoline
Molecule Name in Refrence Article10b compound
IUPAC NameN-(3-chlorophenyl)-6,7-diethoxyquinazolin-4-amine
FormulaC18H18ClN3O2
Mass343.807
Exact Mass343.1087545
Composition C (62.88%), H (5.28%), Cl (10.31%), N (12.22%), O (9.31%)
Atom Count42
PI10.26
Smilesc12c(ncnc1cc(c(c2)OCC)OCC)Nc1cc(Cl)ccc1
InChI1S/C18H18ClN3O2/c1-3-23-16-9-14-15(10-17(16)24-4-2)20-11-21-18(14)22-13-7-5-6-12(19)8-13/h5-11H,3-4H
2,1-2H3,(H,20,21,22)
InChIKeyVXCUTOVXETTYDM-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
Reference16279804
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 11660897
Drug Bank Link -
ChemSpider Link 9835632
ChEMBL Link CHEMBL64950
 
TOP