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SMILES: [#7]\[#6](-[#7])=[#7]\[#6]-[#6]-[#8]-c1ccc(Cl)c(c1)-[#6](=O)-[#7]-c1sc2-[#6]-[#6]-[#6]-[#6]-c2c1C#N

InChI Key: InChIKey=PXDYRENUYWDBPH-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50447050   
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
UDP-N-acetylmuramoyl-tripeptide--D-alanyl-D-alanine ligase


(Streptococcus pneumoniae)		BDBM50447050
PNG
(CHEMBL3112632)
Show SMILES [#7]\[#6](-[#7])=[#7]\[#6]-[#6]-[#8]-c1ccc(Cl)c(c1)-[#6](=O)-[#7]-c1sc2-[#6]-[#6]-[#6]-[#6]-c2c1C#N
Show InChI InChI=1S/C19H20ClN5O2S/c20-15-6-5-11(27-8-7-24-19(22)23)9-13(15)17(26)25-18-14(10-21)12-3-1-2-4-16(12)28-18/h5-6,9H,1-4,7-8H2,(H,25,26)(H4,22,23,24)
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UniProtKB/TrEMBL

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PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 7.50E+4n/an/an/an/an/an/a



University of Ljubljana

Curated by ChEMBL


Assay Description
Inhibition of Streptococcus pneumoniae MurF ligase using D-Ala-D-Ala as substrate after 15 mins by malachite green assay

Eur J Med Chem 73: 83-96 (2014)


Article DOI: 10.1016/j.ejmech.2013.11.031
BindingDB Entry DOI: 10.7270/Q20K2B1T
More data for this
Ligand-Target Pair