BDBM11985 4-(2,5-dimethyl-1H-pyrrol-1-yl)-2-hydroxybenzoic acid::Salicylic acid derivative, compound 1::chemical diversity library compound 10

SMILES Cc1ccc(C)n1-c1ccc(C(O)=O)c(O)c1

InChI Key InChIKey=WAYCNXGAKFXIKA-UHFFFAOYSA-N

Data  2 KI  3 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 = 11985   

TargetLethal factor(Bacillus anthracis)
Montana State University

LigandPNGBDBM11985(4-(2,5-dimethyl-1H-pyrrol-1-yl)-2-hydroxybenzoic a...)
Affinity DataKi:  1.50E+3nM ΔG°:  -7.99kcal/mole IC50:  3.80E+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