Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0004842
Inhibitor ClassUnknown
Molecule Name in Refrence Article6
IUPAC Name4-({3-[(4-acetamidophenyl)sulfonamido]quinoxalin-2-yl}amino)benzoic acid
FormulaC23H19N5O5S
Mass477.492
Exact Mass477.1106894
Composition C (57.85%), H (4.01%), N (14.67%), O (16.75%), S (6.72%)
Atom Count53
PI2.22
Smilesc1c(ccc(c1)S(=O)(=O)Nc1nc2c(nc1Nc1ccc(cc1)C(=O)O)cccc2)NC(=O)C
InChI1S/C23H19N5O5S/c1-14(29)24-16-10-12-18(13-11-16)34(32,33)28-22-21(26-19-4-2-3-5-20(19)27-22)25-17-8-
6-15(7-9-17)23(30)31/h2-13H,1H3,(H,24,29)(H,25,26)(H,27,28)(H,30,31)
InChIKeyAZYFTAYNMPTQPL-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
Reference22227214
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesNo activity data against other kinases present in database
Pub Chem Link 1900460
Drug Bank Link -
ChemSpider Link 1463505
ChEMBL Link CHEMBL1944923
 
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