BDBM11982 2-{[(2-amino-2-carboxyethyl)sulfanyl]methyl}-5-phenylfuran-3-carboxylic acid::chemical diversity library compound 7

SMILES NC(CSCc1oc(cc1C(O)=O)-c1ccccc1)C(O)=O

InChI Key InChIKey=OWKFSBMZASSGMV-UHFFFAOYSA-N

Data  1 KI  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 = 11982   

TargetLethal factor(Bacillus anthracis)
Montana State University

LigandPNGBDBM11982(2-{[(2-amino-2-carboxyethyl)sulfanyl]methyl}-5-phe...)
Affinity DataKi:  2.90E+3nM ΔG°:  -7.60kcal/mole IC50:  4.10E+3nMpH: 7.2 T: 2°CAssay Description:For selected lead compounds from fluorescence-based high-throughput screening, Km and Vmax were calculated using the double-reciprocal Lineweaver-Bur...More data for this Ligand-Target Pair
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