Epidermal Growth Factor Receptor Inhibitor Database


General Property
Molceule ID (DB)EGIN0004801
Inhibitor ClassUnknown
Molecule Name in Refrence Article11
IUPAC Name(4Z)-1-(4-fluorophenyl)-4-({3-[(2-fluorophenyl)methoxy]phenyl}methylidene)pyrazolidine-3,5-dione
FormulaC23H16F2N2O3
Mass406.3815
Exact Mass406.1128988
Composition C (67.98%), H (3.97%), F (9.35%), N (6.89%), O (11.81%)
Atom Count46
PINo isoelectric point.
Smilesc1c(ccc(c1)N1C(=O)/C(=Cc2cccc(c2)OCc2c(cccc2)F)/C(=O)N1)F
InChI1S/C23H16F2N2O3/c24-17-8-10-18(11-9-17)27-23(29)20(22(28)26-27)13-15-4-3-6-19(12-15)30-14-16-5-1-2-7
-21(16)25/h1-13H,14H2,(H,26,28)/b20-13-
InChIKeyOPNOKMCPQWTTTB-MOSHPQCFSA-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
Reference22595177
Compounds from ReferenceOther compounds from reference
Find Similar Compounds
                                   

Reported activity against other enzymesNo activity data against other kinases present in database
Pub Chem Link 1018252
Drug Bank Link -
ChemSpider Link 1421000
ChEMBL Link -
 
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