Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0004699
Inhibitor ClassNicotinamide
Molecule Name in Refrence Article23
IUPAC NameN-[(4-bromophenyl)sulfonyl]-2-chloro-6-methylpyridine-3-carboxamide
FormulaC13H10BrClN2O3S
Mass389.652
Exact Mass387.9284032
Composition C (40.07%), H (2.59%), Br (20.51%), Cl (9.1%), N (7.19%), O (12.32%), S (8.23%)
Atom Count31
PI2.43
Smilesc1cc(nc(c1C(=O)NS(=O)(=O)c1ccc(cc1)Br)Cl)C
InChI1S/C13H10BrClN2O3S/c1-8-2-7-11(12(15)16-8)13(18)17-21(19,20)10-5-3-9(14)4-6-10/h2-7H,1H3,(H,17,18)
InChIKeyARHVERBRASNVPZ-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 57394394
Drug Bank Link -
ChemSpider Link 28480000
ChEMBL Link CHEMBL1945648
 
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