Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0003744
Inhibitor ClassIndolinone
Molecule Name in Refrence Article62 compound
IUPAC Name(3Z)-3-[(4-chloro-1H-pyrazol-3-yl)methylidene]-2,3-dihydro-1H-indol-2-one
FormulaC12H8ClN3O
Mass245.664
Exact Mass245.0355896
Composition C (58.67%), H (3.28%), Cl (14.43%), N (17.1%), O (6.51%)
Atom Count25
PI6.3
SmilesC1(=C/c2c(c[nH]n2)Cl)/C(=O)Nc2c1cccc2
InChI1S/C12H8ClN3O/c13-9-6-14-16-11(9)5-8-7-3-1-2-4-10(7)15-12(8)17/h1-6H,(H,14,16)(H,15,17)/b8-5-
InChIKeyGWLUGYITWVGWFU-YVMONPNESA-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 53861007
Drug Bank Link -
ChemSpider Link 10334577
ChEMBL Link CHEMBL87402
 
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