BDBM50053021 2-Hydroxy-2-[6-(4-nitro-phenyl)-hexylsulfanylmethyl]-succinic acid::CHEMBL120649

SMILES OC(=O)CC(O)(CSCCCCCCc1ccc(cc1)[N+]([O-])=O)C(O)=O

InChI Key InChIKey=ZJEZCFVHXISELD-UHFFFAOYSA-N

Data  1 KI

  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 = 50053021   

TargetATP-citrate synthase(Rat)
Smithkline Beecham Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50053021(2-Hydroxy-2-[6-(4-nitro-phenyl)-hexylsulfanylmethy...)
Affinity DataKi:  3.40E+5nMAssay Description:Inhibitory activity against human recombinant ATP-Citrate Lyase activity was measured by the maleate dehydrogenase catalyzed reduction of oxaloacetat...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed