Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0003803
Inhibitor ClassIndolinone
Molecule Name in Refrence Article11e compound
IUPAC Name3-(4-methyl-5-{[(3Z)-2-oxo-6-phenyl-2,3-dihydro-1H-indol-3-ylidene]methyl}-1H-pyrrol-3-yl)propanoic acid
FormulaC23H20N2O3
Mass372.4165
Exact Mass372.1473925
Composition C (74.18%), H (5.41%), N (7.52%), O (12.89%)
Atom Count48
PI1
SmilesC1(=Cc2[nH]cc(c2C)CCC(=O)O)/C(=O)Nc2c1ccc(c2)c1ccccc1
InChI1S/C23H20N2O3/c1-14-17(8-10-22(26)27)13-24-20(14)12-19-18-9-7-16(11-21(18)25-23(19)28)15-5-3-2-4-6-1
5/h2-7,9,11-13,24H,8,10H2,1H3,(H,25,28)(H,26,27)/b19-12-
InChIKeyCEFJMJRPRONXNH-UNOMPAQXSA-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 5329142
Drug Bank Link -
ChemSpider Link 4486304 21202100
ChEMBL Link CHEMBL347074
 
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