Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0003765
Inhibitor ClassPyrido-pyrimidine
Molecule Name in Refrence Article39 compound
IUPAC Name6-(2,6-dichlorophenyl)-8-ethyl-2-(phenylamino)-7H,8H-pyrido[2,3-d]pyrimidin-7-one
FormulaC21H16Cl2N4O
Mass411.284
Exact Mass410.0701166
Composition C (61.33%), H (3.92%), Cl (17.24%), N (13.62%), O (3.89%)
Atom Count44
PI7.39
Smilesn1(c2nc(ncc2cc(c1=O)c1c(Cl)cccc1Cl)Nc1ccccc1)CC
InChI1S/C21H16Cl2N4O/c1-2-27-19-13(12-24-21(26-19)25-14-7-4-3-5-8-14)11-15(20(27)28)18-16(22)9-6-10-17(18
)23/h3-12H,2H2,1H3,(H,24,25,26)
InChIKeyXZBKAAPFQAVYSN-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
Reference9703473
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesFGFr | c-Src | PDGFr | ALL
Pub Chem Link 5327886
Drug Bank Link -
ChemSpider Link 4485056
ChEMBL Link CHEMBL322298
 
TOP