Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0004705
Inhibitor ClassNicotinamide
Molecule Name in Refrence Article22
IUPAC Name2-chloro-6-methyl-N-[(4-methylphenyl)sulfonyl]pyridine-3-carboxamide
FormulaC14H13ClN2O3S
Mass324.783
Exact Mass324.0335407
Composition C (51.77%), H (4.03%), Cl (10.92%), N (8.63%), O (14.78%), S (9.87%)
Atom Count34
PI2.43
Smilesc1cc(nc(c1C(=O)NS(=O)(=O)c1ccc(cc1)C)Cl)C
InChI1S/C14H13ClN2O3S/c1-9-3-6-11(7-4-9)21(19,20)17-14(18)12-8-5-10(2)16-13(12)15/h3-8H,1-2H3,(H,17,18)
InChIKeyHYSDNMWSBYIISH-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
Reference22277588
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 57397975
Drug Bank Link -
ChemSpider Link 28479999
ChEMBL Link CHEMBL1945647
 
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