BDBM41920 MLS000533584::N-(3,4-dichlorophenyl)-4-({[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]amino}methyl)-1-piperidinecarboxamide::N-(3,4-dichlorophenyl)-4-[[(2,6-diketo-4,4-dimethyl-cyclohexylidene)methylamino]methyl]piperidine-1-carboxamide::N-(3,4-dichlorophenyl)-4-[[(4,4-dimethyl-2,6-dioxocyclohexylidene)methylamino]methyl]-1-piperidinecarboxamide::N-(3,4-dichlorophenyl)-4-[[(4,4-dimethyl-2,6-dioxocyclohexylidene)methylamino]methyl]piperidine-1-carboxamide::N-(3,4-dichlorophenyl)-4-[[[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexylidene]methylamino]methyl]piperidine-1-carboxamide::SMR000141022::cid_1350513

SMILES [#6]C1([#6])[#6]-[#6](=O)\[#6](=[#6]\[#7]-[#6]-[#6]-2-[#6]-[#6]-[#7](-[#6]-[#6]-2)-[#6](=O)-[#7]-c2ccc(Cl)c(Cl)c2)-[#6](=O)-[#6]1

InChI Key InChIKey=KBUTYIACTQOKCV-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 41920   

TargetBifunctional epoxide hydrolase 2(Human)
Columbia University Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM41920(N-(3,4-dichlorophenyl)-4-[[(4,4-dimethyl-2,6-dioxo...)
Affinity DataIC50: 27.3nMAssay Description:Data Source: Columbia University Molecular Screening Center Source (MLSCN Center Name): Columbia University Molecular Screening Center Center Affilia...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/17/2011
Entry Details
PCBioAssay