Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0003738
Inhibitor ClassIndolinone
Molecule Name in Refrence Article56 compound
IUPAC Name(3Z)-3-{[5-(methylsulfanyl)thiophen-2-yl]methylidene}-2,3-dihydro-1H-indol-2-one
FormulaC14H11NOS2
Mass273.373
Exact Mass273.0282054
Composition C (61.51%), H (4.06%), N (5.12%), O (5.85%), S (23.46%)
Atom Count29
PI4.61
SmilesC1(=C/c2sc(cc2)SC)/C(=O)Nc2c1cccc2
InChI1S/C14H11NOS2/c1-17-13-7-6-9(18-13)8-11-10-4-2-3-5-12(10)15-14(11)16/h2-8H,1H3,(H,15,16)/b11-8-
InChIKeyFEISFUIEFYIRAS-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 10636005
Drug Bank Link -
ChemSpider Link 8811367
ChEMBL Link CHEMBL89721
 
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