Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0001260
Inhibitor ClassChrysin
Molecule Name in Refrence Article9 compound
IUPAC Nametetradecyl 2-[(5-hydroxy-4-oxo-2-phenyl-4H-chromen-7-yl)oxy]acetate
FormulaC31H40O6
Mass508.6457
Exact Mass508.282489
Composition C (73.2%), H (7.93%), O (18.87%)
Atom Count77
PI1.82
Smilesc12c(c(cc(c1)OCC(=O)OCCCCCCCCCCCCCC)O)c(=O)cc(o2)c1ccccc1
InChI1S/C31H40O6/c1-2-3-4-5-6-7-8-9-10-11-12-16-19-35-30(34)23-36-25-20-26(32)31-27(33)22-28(37-29(31)21-
25)24-17-14-13-15-18-24/h13-15,17-18,20-22,32H,2-12,16,19,23H2,1H3
InChIKeyIBHLXNGSNVBLIQ-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
Reference20056425
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesNo activity data against other kinases present in database
Pub Chem Link 46231686
Drug Bank Link -
ChemSpider Link 24649486
ChEMBL Link CHEMBL598306
 
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