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SMILES: OC[C@H](OCC(=O)NO)c1ccc(cc1)C#C

InChI Key: InChIKey=IQDVTAAEEJHKCE-NSHDSACASA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50495326   
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-3-O-acyl-N-acetylglucosamine deacetylase


(Escherichia coli)		BDBM50495326
PNG
(CHEMBL3103556)
Show SMILES OC[C@H](OCC(=O)NO)c1ccc(cc1)C#C |r|
Show InChI InChI=1S/C12H13NO4/c1-2-9-3-5-10(6-4-9)11(7-14)17-8-12(15)13-16/h1,3-6,11,14,16H,7-8H2,(H,13,15)/t11-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a>2.00E+5n/an/an/an/an/an/a



Institut f£r Pharmazeutische und Medizinische Chemie der Westf£lischen Wilhelms-Universit£t M£nster

Curated by ChEMBL


Assay Description
Inhibition of Escherichia coli LpxC using UDP-3-O-[(R)-3-hydroxymyristoyl]-N-acetylglucosamine as substrate incubated for 30 mins prior to enzyme add...

Bioorg Med Chem 22: 1016-28 (2014)


Article DOI: 10.1016/j.bmc.2013.12.057
BindingDB Entry DOI: 10.7270/Q2X92F7C
More data for this
Ligand-Target Pair