BDBM43389 1-[(2,5-dimethylanilino)-sulfanylidenemethyl]-4-piperidinecarboxylic acid ethyl ester::1-[(2,5-dimethylphenyl)thiocarbamoyl]isonipecotic acid ethyl ester::MLS000579277::SMR000198557::cid_891954::ethyl 1-[(2,5-dimethylphenyl)carbamothioyl]piperidine-4-carboxylate::ethyl 1-{[(2,5-dimethylphenyl)amino]carbonothioyl}-4-piperidinecarboxylate

SMILES CCOC(=O)C1CCN(CC1)C(=S)Nc1cc(C)ccc1C

InChI Key InChIKey=IZMZHEQODRDPGW-UHFFFAOYSA-N

Data  1 EC50

  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 = 43389   

LigandPNGBDBM43389(1-[(2,5-dimethylanilino)-sulfanylidenemethyl]-4-pi...)
Affinity DataEC50:  4.34E+3nMAssay Description:Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Brent Stockwell, Columbia University ML...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/21/2011
Entry Details
PCBioAssay