Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0003884
Inhibitor ClassIndolinone
Molecule Name in Refrence Article4b compound
IUPAC Name(3Z)-5-bromo-3-(4,5,6,7-tetrahydro-1H-indol-2-ylmethylidene)-2,3-dihydro-1H-indol-2-one
FormulaC17H15BrN2O
Mass343.218
Exact Mass342.0367758
Composition C (59.49%), H (4.41%), Br (23.28%), N (8.16%), O (4.66%)
Atom Count36
PI4.58
SmilesC1(=C/c2[nH]c3c(c2)CCCC3)/C(=O)Nc2c1cc(cc2)Br
InChI1S/C17H15BrN2O/c18-11-5-6-16-13(8-11)14(17(21)20-16)9-12-7-10-3-1-2-4-15(10)19-12/h5-9,19H,1-4H2,(H,
20,21)/b14-9-
InChIKeyRFHPWPWVGFSLOP-ZROIWOOFSA-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
Reference10893303
Compounds from ReferenceOther compounds from reference
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Reported activity against other enzymesFGFR1 | p60c-Src | VEGFR2 | PDGFR beta | ALL
Pub Chem Link 5329155
Drug Bank Link -
ChemSpider Link 4486317
ChEMBL Link CHEMBL88606
 
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