Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0003795
Inhibitor ClassIndolinone
Molecule Name in Refrence Article9a compound
IUPAC Name3-(4-methyl-2-{[(3Z)-4-methyl-2-oxo-2,3-dihydro-1H-indol-3-ylidene]methyl}-1H-pyrrol-3-yl)propanoic acid
FormulaC18H18N2O3
Mass310.3471
Exact Mass310.1317425
Composition C (69.66%), H (5.85%), N (9.03%), O (15.47%)
Atom Count41
PI1.15
SmilesC1(=C/c2c(c(c[nH]2)C)CCC(=O)O)/C(=O)Nc2c1c(ccc2)C
InChI1S/C18H18N2O3/c1-10-4-3-5-14-17(10)13(18(23)20-14)8-15-12(6-7-16(21)22)11(2)9-19-15/h3-5,8-9,19H,6-7
H2,1-2H3,(H,20,23)(H,21,22)/b13-8-
InChIKeyWFEYKXAXXWJCGD-JYRVWZFOSA-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 5329134
Drug Bank Link -
ChemSpider Link 4486296
ChEMBL Link CHEMBL147761
 
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