Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002892
Inhibitor ClassAmino-salicylate
Molecule Name in Refrence ArticleII5 compound
IUPAC NameN-(benzyloxy)-2-(5-{[(2,5-dihydroxyphenyl)methyl]amino}-2-hydroxyphenyl)acetamide
FormulaC22H22N2O5
Mass394.4205
Exact Mass394.1528718
Composition C (66.99%), H (5.62%), N (7.1%), O (20.28%)
Atom Count51
PI6.55
Smilesc1(c(ccc(c1)O)O)CNc1cc(CC(=O)NOCc2ccccc2)c(cc1)O
InChI1S/C22H22N2O5/c25-19-7-9-21(27)17(11-19)13-23-18-6-8-20(26)16(10-18)12-22(28)24-29-14-15-4-2-1-3-5-1
5/h1-11,23,25-27H,12-14H2,(H,24,28)
InChIKeyNYVYOBPBOHULAP-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
Reference8145236
Compounds from ReferenceOther compounds from reference
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Reported activity against other enzymesNo activity data against other kinases present in database
Pub Chem Link 10453233
Drug Bank Link -
ChemSpider Link 8628649
ChEMBL Link CHEMBL352589
 
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