Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0003740
Inhibitor ClassIndolinone
Molecule Name in Refrence Article58 compound
IUPAC Name(3Z)-3-[(5-ethylthiophen-2-yl)methylidene]-2,3-dihydro-1H-indol-2-one
FormulaC15H13NOS
Mass255.335
Exact Mass255.0717847
Composition C (70.56%), H (5.13%), N (5.49%), O (6.27%), S (12.56%)
Atom Count31
PI4.61
SmilesC1(=C/c2sc(cc2)CC)/C(=O)Nc2c1cccc2
InChI1S/C15H13NOS/c1-2-10-7-8-11(18-10)9-13-12-5-3-4-6-14(12)16-15(13)17/h3-9H,2H2,1H3,(H,16,17)/b13-9-
InChIKeyMFRZHGSWQHNIEA-LCYFTJDESA-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 10682457
Drug Bank Link -
ChemSpider Link 8857803
ChEMBL Link CHEMBL314146
 
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