BDBM11976 5-chloro-2-(5-{[(4E)-3,8-dioxo-5,16-dithia-2,7-diazatetracyclo[7.7.0.0^{2,6}.0^{10,15}]hexadeca-1(9),6,10(15)-trien-4-ylidene]methyl}furan-2-yl)benzoic acid::chemical diversity library compound 1

SMILES OC(=O)c1cc(Cl)ccc1-c1ccc(\C=c2\sc3nc(=O)c4c5CCCCc5sc4n3c2=O)o1

InChI Key InChIKey=GMZMCGWDPXYCHY-VCHYOVAHSA-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 = 11976   

TargetLethal factor(Bacillus anthracis)
Montana State University

LigandPNGBDBM11976(5-chloro-2-(5-{[(4E)-3,8-dioxo-5,16-dithia-2,7-dia...)
Affinity DataKi:  800nM ΔG°:  -8.37kcal/mole IC50:  1.10E+3nMpH: 7.2 T: 27°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