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SMILES: CCc1cc(I)c2NCCC(NCCCNc3nc4ncccc4[nH]3)c2c1

InChI Key: InChIKey=GUACDAXYBKVFIR-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50149619   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Methionine--tRNA ligase


(Staphylococcus aureus (strain MW2))		BDBM50149619
PNG
(CHEMBL182821 | N-(6-Ethyl-8-iodo-1,2,3,4-tetrahydr...)
Show SMILES CCc1cc(I)c2NCCC(NCCCNc3nc4ncccc4[nH]3)c2c1
Show InChI InChI=1S/C20H25IN6/c1-2-13-11-14-16(6-10-23-18(14)15(21)12-13)22-8-4-9-25-20-26-17-5-3-7-24-19(17)27-20/h3,5,7,11-12,16,22-23H,2,4,6,8-10H2,1H3,(H2,24,25,26,27)
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KEGG

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Article
PubMed
n/an/a 18n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibitory concentration against Staphylococcus aureus methionyl tRNA synthetase

Bioorg Med Chem Lett 14: 3937-41 (2004)


Article DOI: 10.1016/j.bmcl.2004.05.070
BindingDB Entry DOI: 10.7270/Q2QC02Z9
More data for this
Ligand-Target Pair