Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0003720
Inhibitor ClassIndolinone
Molecule Name in Refrence Article38 compound
IUPAC Name(3Z)-4-methyl-3-(1H-pyrrol-2-ylmethylidene)-2,3-dihydro-1H-indol-2-one
FormulaC14H12N2O
Mass224.2579
Exact Mass224.094963
Composition C (74.98%), H (5.39%), N (12.49%), O (7.13%)
Atom Count29
PI4.77
SmilesC1(=C/c2[nH]ccc2)/C(=O)Nc2c1c(ccc2)C
InChI1S/C14H12N2O/c1-9-4-2-6-12-13(9)11(14(17)16-12)8-10-5-3-7-15-10/h2-8,15H,1H3,(H,16,17)/b11-8-
InChIKeyIUMPCHAHZBLTKY-FLIBITNWSA-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
Reference9651163
Compounds from ReferenceOther compounds from reference
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Reported activity against other enzymesIGF1R | PDGFR | FLK-1 | ALL
Pub Chem Link -
Drug Bank Link DB03737
ChemSpider Link 8664725
ChEMBL Link CHEMBL85403
 
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