BDBM47394 2-[(2-fluoranyl-6-nitro-phenyl)methylsulfanyl]-4,6-dimethyl-pyridine-3-carbonitrile::2-[(2-fluoro-6-nitro-benzyl)thio]-4,6-dimethyl-nicotinonitrile::2-[(2-fluoro-6-nitrophenyl)methylsulfanyl]-4,6-dimethylpyridine-3-carbonitrile::2-[(2-fluoro-6-nitrophenyl)methylthio]-4,6-dimethyl-3-pyridinecarbonitrile::UNM000011100101::cid_2792223

SMILES Cc1cc(C)c(C#N)c(SCc2c(F)cccc2[N+]([O-])=O)n1

InChI Key InChIKey=ULPDKIDHNWLQJE-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 = 47394   

LigandPNGBDBM47394(2-[(2-fluoranyl-6-nitro-phenyl)methylsulfanyl]-4,6...)
Affinity DataEC50:  3.82E+3nMAssay Description:University of New Mexico Assay Overview: Assay Support:1R03MH081228-01A1 High-throughput multiplex screening for ABC transporter inhibitors PI: Rich...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/29/2011
Entry Details
PCBioAssay