Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0003706
Inhibitor ClassIndolinone
Molecule Name in Refrence Article24 compound
IUPAC Name(3Z)-3-{[4-(piperidin-1-yl)phenyl]methylidene}-2,3-dihydro-1H-indol-2-one
FormulaC20H20N2O
Mass304.3856
Exact Mass304.1575633
Composition C (78.92%), H (6.62%), N (9.2%), O (5.26%)
Atom Count43
PI8.24
SmilesC1(=C/c2ccc(N3CCCCC3)cc2)/C(=O)Nc2c1cccc2
InChI1S/C20H20N2O/c23-20-18(17-6-2-3-7-19(17)21-20)14-15-8-10-16(11-9-15)22-12-4-1-5-13-22/h2-3,6-11,14H,
1,4-5,12-13H2,(H,21,23)/b18-14-
InChIKeyYKIYMEVKKILHAK-JXAWBTAJSA-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 -
Drug Bank Link -
ChemSpider Link 8124021
ChEMBL Link CHEMBL315701
 
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