BDBM51747 4-(3-Cyano-6-ethyl-5-methyl-pyridin-2-ylsulfanyl)-3-oxo-butyric acid ethyl ester::4-[(3-cyano-6-ethyl-5-methyl-2-pyridinyl)thio]-3-oxobutanoic acid ethyl ester::4-[(3-cyano-6-ethyl-5-methyl-2-pyridyl)thio]-3-keto-butyric acid ethyl ester::MLS000779944::SMR000420110::cid_1963384::ethyl 4-(3-cyano-6-ethyl-5-methyl-pyridin-2-yl)sulfanyl-3-oxidanylidene-butanoate::ethyl 4-(3-cyano-6-ethyl-5-methylpyridin-2-yl)sulfanyl-3-oxobutanoate

SMILES CCOC(=O)CC(=O)CSc1nc(CC)c(C)cc1C#N

InChI Key InChIKey=RTIUWRUBQAYDPQ-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 = 51747   

TargetdTDP-4-dehydrorhamnose 3,5-epimerase(Mycobacterium tuberculosis (strain CDC 1551 / Oshk...)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM51747(4-(3-Cyano-6-ethyl-5-methyl-pyridin-2-ylsulfanyl)-...)
Affinity DataIC50: 1.79E+3nMAssay Description:Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Michael McNeil, Colorado State Universi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/31/2011
Entry Details
PCBioAssay