Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0003763
Inhibitor ClassPyrido-pyrimidine
Molecule Name in Refrence Article37 compound
IUPAC Name6-{[6-(2,6-dichlorophenyl)-8-methyl-7-oxo-7H,8H-pyrido[2,3-d]pyrimidin-2-yl]amino}hexanoic acid
FormulaC20H20Cl2N4O3
Mass435.304
Exact Mass434.0912459
Composition C (55.18%), H (4.63%), Cl (16.29%), N (12.87%), O (11.03%)
Atom Count49
PI3.17
Smilesn1(c2nc(ncc2cc(c1=O)c1c(Cl)cccc1Cl)NCCCCCC(=O)O)C
InChI1S/C20H20Cl2N4O3/c1-26-18-12(10-13(19(26)29)17-14(21)6-5-7-15(17)22)11-24-20(25-18)23-9-4-2-3-8-16(2
7)28/h5-7,10-11H,2-4,8-9H2,1H3,(H,27,28)(H,23,24,25)
InChIKeyGWLRNLPJEBRBCZ-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 5327884
Drug Bank Link -
ChemSpider Link 4485054
ChEMBL Link CHEMBL113863
 
TOP