Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0004868
Inhibitor ClassNicotinamide
Molecule Name in Refrence Article3
IUPAC NameN-[(4-fluorophenyl)sulfonyl]pyridine-3-carboxamide
FormulaC12H9FN2O3S
Mass280.275
Exact Mass280.0317911
Composition C (51.42%), H (3.24%), F (6.78%), N (9.99%), O (17.13%), S (11.44%)
Atom Count28
PI3.83
Smilesc1ccncc1C(=O)NS(=O)(=O)c1ccc(cc1)F
InChI1S/C12H9FN2O3S/c13-10-3-5-11(6-4-10)19(17,18)15-12(16)9-2-1-7-14-8-9/h1-8H,(H,15,16)
InChIKeyVZVYQSHBWJSSJP-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 57399859
Drug Bank Link -
ChemSpider Link 28480322
ChEMBL Link CHEMBL1916948
 
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