Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0002630
Inhibitor ClassHydroxybiphenyl
Molecule Name in Refrence Article34 compound
IUPAC NameN-benzyl-4-(3-tert-butyl-5-hydroxyphenyl)benzamide
FormulaC24H25NO2
Mass359.4608
Exact Mass359.188529
Composition C (80.19%), H (7.01%), N (3.9%), O (8.9%)
Atom Count52
PI4.39
SmilesCC(C)(C)c1cc(cc(O)c1)c1ccc(cc1)C(=O)NCc1ccccc1
InChI1S/C24H25NO2/c1-24(2,3)21-13-20(14-22(26)15-21)18-9-11-19(12-10-18)23(27)25-16-17-7-5-4-6-8-17/h4-15
,26H,16H2,1-3H3,(H,25,27)
InChIKeyGYILJKVKRPIVKD-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
Reference7473597
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 10618464
Drug Bank Link -
ChemSpider Link 8793829
ChEMBL Link CHEMBL143160
 
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