BDBM11991 8-{N-[4-(2,3-dihydro-1,3-thiazol-2-ylsulfamoyl)phenyl]carboximidoyl}-2,4-dihydro-1,3-benzodioxine-6-carboxylic acid::chemical diversity library compound 16

SMILES OC(=O)c1cc2COCOc2c(C=Nc2ccc(cc2)S(=O)(=O)NC2SCC=N2)c1

InChI Key InChIKey=MNYLDMABQDFESN-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 = 11991   

TargetLethal factor(Bacillus anthracis)
Montana State University

LigandPNGBDBM11991(8-{N-[4-(2,3-dihydro-1,3-thiazol-2-ylsulfamoyl)phe...)
Affinity DataKi:  1.80E+3nM ΔG°:  -7.88kcal/mole IC50:  8.70E+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
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed