Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0003750
Inhibitor ClassPyrido-pyrimidine
Molecule Name in Refrence Article24 compound
IUPAC Name2-(butylamino)-6-(2,6-dichlorophenyl)-8-methyl-7H,8H-pyrido[2,3-d]pyrimidin-7-one
FormulaC18H18Cl2N4O
Mass377.268
Exact Mass376.0857666
Composition C (57.3%), H (4.81%), Cl (18.79%), N (14.85%), O (4.24%)
Atom Count43
PI9.23
Smilesn1(c2nc(ncc2cc(c1=O)c1c(Cl)cccc1Cl)NCCCC)C
InChI1S/C18H18Cl2N4O/c1-3-4-8-21-18-22-10-11-9-12(17(25)24(2)16(11)23-18)15-13(19)6-5-7-14(15)20/h5-7,9-1
0H,3-4,8H2,1-2H3,(H,21,22,23)
InChIKeyQOSLUZXSYUGPOU-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 5327871
Drug Bank Link -
ChemSpider Link 4485041
ChEMBL Link CHEMBL332269
 
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