Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0003772
Inhibitor ClassPyrido-pyrimidine
Molecule Name in Refrence Article46 compound
IUPAC Name6-(2,6-dichlorophenyl)-8-methyl-2-[(4-methylphenyl)amino]-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
PI7.57
Smilesc1(ccc(cc1)Nc1nc2c(cn1)cc(c(=O)n2C)c1c(cccc1Cl)Cl)C
InChI1S/C21H16Cl2N4O/c1-12-6-8-14(9-7-12)25-21-24-11-13-10-15(20(28)27(2)19(13)26-21)18-16(22)4-3-5-17(18
)23/h3-11H,1-2H3,(H,24,25,26)
InChIKeyZLNBJDSAGVBJSP-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
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Reported activity against other enzymesPDGFr | c-Src | FGFr | ALL
Pub Chem Link 5327893
Drug Bank Link -
ChemSpider Link 4485063
ChEMBL Link CHEMBL111339
 
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