BDBM11984 2-chloro-4-{5-[N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carboximidoyl]furan-2-yl}benzoic acid::chemical diversity library compound 9

SMILES OC(=O)c1ccc(cc1Cl)-c1ccc(\C=N/c2sc3CCCCc3c2C#N)o1

InChI Key InChIKey=KZWRJUAFFQGMCA-MYKKPKGFSA-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 = 11984   

TargetLethal factor(Bacillus anthracis)
Montana State University

LigandPNGBDBM11984(2-chloro-4-{5-[N-(3-cyano-4,5,6,7-tetrahydro-1-ben...)
Affinity DataKi:  2.40E+3nM ΔG°:  -7.71kcal/mole IC50:  5.20E+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
In DepthDetails ArticlePubMed