Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0000833
Inhibitor ClassSalicylanilide
Molecule Name in Refrence Article25 compound
IUPAC NameN-(4-bromophenyl)-2-hydroxy-5-iodobenzamide
FormulaC13H9BrINO2
Mass418.025
Exact Mass416.8861346
Composition C (37.35%), H (2.17%), Br (19.11%), I (30.36%), N (3.35%), O (7.65%)
Atom Count27
PI1.6
Smilesc1(c(ccc(c1)I)O)C(=O)Nc1ccc(cc1)Br
InChI1S/C13H9BrINO2/c14-8-1-4-10(5-2-8)16-13(18)11-7-9(15)3-6-12(11)17/h1-7,17H,(H,16,18)
InChIKeyODJWEOWHYPZENX-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
Reference20583855
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 11998374
Drug Bank Link -
ChemSpider Link 10170841
ChEMBL Link CHEMBL235283
 
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