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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 50166489   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
UDP-N-acetylenolpyruvoylglucosamine reductase


(Escherichia coli K-12 (Enterobacteria))
BDBM50166489
PNG
(1,2-Bis-(4-chloro-phenyl)-4-(3-methoxy-benzyl)-pyr...)
Show SMILES COc1cccc(Cc2c(O)n(-c3ccc(Cl)cc3)n(-c3ccc(Cl)cc3)c2=O)c1
Show InChI InChI=1S/C23H18Cl2N2O3/c1-30-20-4-2-3-15(13-20)14-21-22(28)26(18-9-5-16(24)6-10-18)27(23(21)29)19-11-7-17(25)8-12-19/h2-13,28H,14H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5.00E+4n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against MurB enzyme in Escherichia coli


Bioorg Med Chem Lett 15: 2527-31 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.058
BindingDB Entry DOI: 10.7270/Q2BG2NHW
More data for this
Ligand-Target Pair
UDP-N-acetylglucosamine 1-carboxyvinyltransferase


(Escherichia coli K-12 (Enterobacteria))
BDBM50166489
PNG
(1,2-Bis-(4-chloro-phenyl)-4-(3-methoxy-benzyl)-pyr...)
Show SMILES COc1cccc(Cc2c(O)n(-c3ccc(Cl)cc3)n(-c3ccc(Cl)cc3)c2=O)c1
Show InChI InChI=1S/C23H18Cl2N2O3/c1-30-20-4-2-3-15(13-20)14-21-22(28)26(18-9-5-16(24)6-10-18)27(23(21)29)19-11-7-17(25)8-12-19/h2-13,28H,14H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>5.00E+4n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against MurA enzyme in Escherichia coli


Bioorg Med Chem Lett 15: 2527-31 (2005)


Article DOI: 10.1016/j.bmcl.2005.03.058
BindingDB Entry DOI: 10.7270/Q2BG2NHW
More data for this
Ligand-Target Pair