Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0003784
Inhibitor ClassPyrido-pyrimidine
Molecule Name in Refrence Article71 compound
IUPAC Name2-(4-{[6-(2,6-dichlorophenyl)-8-methyl-7-oxo-7H,8H-pyrido[2,3-d]pyrimidin-2-yl]amino}phenyl)acetic acid
FormulaC22H16Cl2N4O3
Mass455.293
Exact Mass454.0599458
Composition C (58.04%), H (3.54%), Cl (15.57%), N (12.31%), O (10.54%)
Atom Count47
PI2.5
Smilesn1(c2nc(ncc2cc(c1=O)c1c(Cl)cccc1Cl)Nc1ccc(CC(=O)O)cc1)C
InChI1S/C22H16Cl2N4O3/c1-28-20-13(10-15(21(28)31)19-16(23)3-2-4-17(19)24)11-25-22(27-20)26-14-7-5-12(6-8-
14)9-18(29)30/h2-8,10-11H,9H2,1H3,(H,29,30)(H,25,26,27)
InChIKeyAMKNQROTNAOJQE-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 enzymesc-Src | FGFr | PDGFr | ALL
Pub Chem Link 5327917
Drug Bank Link -
ChemSpider Link 4485087
ChEMBL Link CHEMBL50647
 
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