BDBM50497655 CHEMBL3356187

SMILES c1cc(ccc1CN2CCOCC2)C#Cc3ccc(cc3)OCC4(CCOCC4)C(=O)NO

InChI Key InChIKey=RGQLOHCHGMQBNF-UHFFFAOYSA-N

Data  1 KI  1 IC50

PDB links: 1 PDB ID matches this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50497655   

TargetUDP-3-O-acyl-N-acetylglucosamine deacetylase(Pseudomonas aeruginosa (strain ATCC 15692 / PAO1 /...)
Astrazeneca

Curated by ChEMBL
LigandPNGBDBM50497655(CHEMBL3356187)
Affinity DataIC50: 4.40E+3nMAssay Description:Inhibition of Pseudomonas aeruginosa LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20 mins before substr...More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/3/2020
Entry Details Article
PubMed
TargetUDP-3-O-acyl-N-acetylglucosamine deacetylase(Escherichia coli (strain K12))
Sichuan University

Curated by ChEMBL
LigandPNGBDBM50497655(CHEMBL3356187)
Affinity DataKi:  352nMAssay Description:Inhibition of Escherichia coli LpxC assessed as inhibition constant measured after 30 mins by fluorescence based microplate assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/18/2024
Entry Details
PubMed