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BDBM119113 MurF inhibitor (compound 55)

SMILES: Clc1cc(Cl)c(cc1C(=O)NC1=C(C#N)C2CCCC2S1)S(=O)(=O)N1CCOCC1

InChI Key: InChIKey=IZTDAXBHVRTVKF-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 119113   
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


(Escherichia coli)
BDBM119113
PNG
(MurF inhibitor (compound 55))
Show SMILES Clc1cc(Cl)c(cc1C(=O)NC1=C(C#N)C2CCCC2S1)S(=O)(=O)N1CCOCC1 |c:12|
Show InChI InChI=1S/C19H19Cl2N3O4S2/c20-14-9-15(21)17(30(26,27)24-4-6-28-7-5-24)8-12(14)18(25)23-19-13(10-22)11-2-1-3-16(11)29-19/h8-9,11,16H,1-7H2,(H,23,25)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.00E+3n/an/an/an/an/an/a



University of Ljubljana, A?kerceva 7, 1000 Ljubljana, Slovenia





Bioorg Chem 55: 2-15 (2014)


Article DOI: 10.1016/j.bioorg.2014.03.008
BindingDB Entry DOI: 10.7270/Q2ZG6QWR
More data for this
Ligand-Target Pair