Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0003812
Inhibitor ClassIndolinone
Molecule Name in Refrence Article16e compound
IUPAC Name3-(5-{[(3Z)-6-methoxy-2-oxo-2,3-dihydro-1H-indol-3-ylidene]methyl}-2,4-dimethyl-1H-pyrrol-3-yl)propanoic acid
FormulaC19H20N2O4
Mass340.3731
Exact Mass340.1423071
Composition C (67.05%), H (5.92%), N (8.23%), O (18.8%)
Atom Count45
PI1.04
Smilesc1(/C=C/2C(=O)Nc3c2ccc(c3)OC)[nH]c(c(c1C)CCC(=O)O)C
InChI1S/C19H20N2O4/c1-10-13(6-7-18(22)23)11(2)20-16(10)9-15-14-5-4-12(25-3)8-17(14)21-19(15)24/h4-5,8-9,2
0H,6-7H2,1-3H3,(H,21,24)(H,22,23)/b15-9-
InChIKeyIYOHDJYJJGGYFL-DHDCSXOGSA-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 5329149
Drug Bank Link -
ChemSpider Link 4486311 21202102
ChEMBL Link CHEMBL356245
 
TOP