Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0003802
Inhibitor ClassIndolinone
Molecule Name in Refrence Article11d compound
IUPAC Name3-(5-{[(3Z)-6-methoxy-2-oxo-2,3-dihydro-1H-indol-3-ylidene]methyl}-4-methyl-1H-pyrrol-3-yl)propanoic acid
FormulaC18H18N2O4
Mass326.3465
Exact Mass326.1266571
Composition C (66.25%), H (5.56%), N (8.58%), O (19.61%)
Atom Count42
PI1
SmilesC1(=C/c2[nH]cc(c2C)CCC(=O)O)/C(=O)Nc2c1ccc(c2)OC
InChI1S/C18H18N2O4/c1-10-11(3-6-17(21)22)9-19-15(10)8-14-13-5-4-12(24-2)7-16(13)20-18(14)23/h4-5,7-9,19H,
3,6H2,1-2H3,(H,20,23)(H,21,22)/b14-8-
InChIKeyFTYXAWPLQFJPBB-ZSOIEALJSA-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 enzymesVEGFR2 | PDGFR beta | FGFR1 | ALL
Pub Chem Link 5329141
Drug Bank Link -
ChemSpider Link 4486303
ChEMBL Link CHEMBL149243
 
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