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SMILES: CCC#Cc1ccc(cc1)C1=NOC(CC(C)(C(=O)NO)S(C)(=O)=O)C1

InChI Key: InChIKey=OAJHFDKWDRMWKI-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 264740   
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


(Pseudomonas aeruginosa)		BDBM264740
PNG
(US9718792, 8-B)
Show SMILES CCC#Cc1ccc(cc1)C1=NOC(CC(C)(C(=O)NO)S(C)(=O)=O)C1 |t:11|
Show InChI InChI=1S/C18H22N2O5S/c1-4-5-6-13-7-9-14(10-8-13)16-11-15(25-20-16)12-18(2,17(21)19-22)26(3,23)24/h7-10,15,22H,4,11-12H2,1-3H3,(H,19,21)
PDB

KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
US Patent
n/an/a 0.00100n/an/an/an/a7.525



Novartis AG

US Patent


Assay Description
The P. aeruginosa LpxC protein is produced according to the general method of Hyland et al (Journal of Bacteriology 1997 179, 2029-2037: Cloning, exp...

US Patent US9718792 (2017)


BindingDB Entry DOI: 10.7270/Q2XG9T4Z
More data for this
Ligand-Target Pair