BDBM11977 5-bromo-2-(5-{[(4Z)-1-(3-carboxyphenyl)-5-oxo-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-4-ylidene]methyl}furan-2-yl)benzoic acid::chemical diversity library compound 2

SMILES OC(=O)c1cccc(c1)N1N=C(\C(=C\c2ccc(o2)-c2ccc(Br)cc2C(O)=O)C1=O)C(F)(F)F

InChI Key InChIKey=CDPPDRJSGHLYJL-YVLHZVERSA-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 = 11977   

TargetLethal factor(Bacillus anthracis)
Montana State University

LigandPNGBDBM11977(5-bromo-2-(5-{[(4Z)-1-(3-carboxyphenyl)-5-oxo-3-(t...)
Affinity DataKi:  1.60E+3nM ΔG°:  -7.95kcal/mole IC50:  1.80E+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