Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0003801
Inhibitor ClassIndolinone
Molecule Name in Refrence Article11c compound
IUPAC Name3-(4-methyl-5-{[(3Z)-2-oxo-5-sulfamoyl-2,3-dihydro-1H-indol-3-ylidene]methyl}-1H-pyrrol-3-yl)propanoic acid
FormulaC17H17N3O5S
Mass375.399
Exact Mass375.0888914
Composition C (54.39%), H (4.56%), N (11.19%), O (21.31%), S (8.54%)
Atom Count43
PI0.92
SmilesC1(=C/c2[nH]cc(c2C)CCC(=O)O)/C(=O)Nc2c1cc(S(=O)(=O)N)cc2
InChI1S/C17H17N3O5S/c1-9-10(2-5-16(21)22)8-19-15(9)7-13-12-6-11(26(18,24)25)3-4-14(12)20-17(13)23/h3-4,6-
8,19H,2,5H2,1H3,(H,20,23)(H,21,22)(H2,18,24,25)/b13-7-
InChIKeyYLOCIDYFMMJTMC-QPEQYQDCSA-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
Reference10602697
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesFGFR1 | PDGFR beta | VEGFR2 | ALL
Pub Chem Link 5329140
Drug Bank Link -
ChemSpider Link 4486302
ChEMBL Link CHEMBL146697
 
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