BDBM19822 (1R,2R)-N-(cyanomethyl)-2-({[4-(methylsulfanyl)phenyl]sulfanyl}methyl)cyclohexane-1-carboxamide::Cyclohexanecarboxamide derivative, 12f::racemic mixture

SMILES CSc1ccc(SC[C@@H]2CCCC[C@H]2C(=O)NCC#N)cc1

InChI Key InChIKey=YSZNEWUCGOECCV-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 19822   

TargetCathepsin K(Rabbit)
Merck Frosst Centre For Therapeutic Research

LigandPNGBDBM19822(racemic mixture | (1R,2R)-N-(cyanomethyl)-2-({[4-(...)
Affinity DataIC50: 4.20nMpH: 5.5 T: 2°CAssay Description:Prior to the addition of substrate, different concentrations of the inhibitor ranging from 100 uM to 0.2 nM were preincubated for 15 min with enzyme ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/4/2008
Entry Details Article
PubMed