Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0003721
Inhibitor ClassIndolinone
Molecule Name in Refrence Article39 compound
IUPAC Name(3Z)-5-chloro-3-(1H-pyrrol-2-ylmethylidene)-2,3-dihydro-1H-indol-2-one
FormulaC13H9ClN2O
Mass244.676
Exact Mass244.0403406
Composition C (63.81%), H (3.71%), Cl (14.49%), N (11.45%), O (6.54%)
Atom Count26
PI4.59
SmilesC1(=C/c2[nH]ccc2)/C(=O)Nc2c1cc(cc2)Cl
InChI1S/C13H9ClN2O/c14-8-3-4-12-10(6-8)11(13(17)16-12)7-9-2-1-5-15-9/h1-7,15H,(H,16,17)/b11-7-
InChIKeySYFAEBVHHBJQER-XFFZJAGNSA-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 | FLK-1 | PDGFR | ALL
Pub Chem Link -
Drug Bank Link DB07180--DB08009
ChemSpider Link 8737694
ChEMBL Link CHEMBL431025
 
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