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BDBM50498105 CHEMBL3403858

SMILES: CCCCCCc1cn(CC(=O)N[C@H]2CCOC2=O)nn1

InChI Key: InChIKey=WOQMKALKMWWBIJ-LBPRGKRZSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50498105   
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
Pseudolysin


(Pseudomonas aeruginosa)
BDBM50498105
PNG
(CHEMBL3403858)
Show SMILES CCCCCCc1cn(CC(=O)N[C@H]2CCOC2=O)nn1 |r|
Show InChI InChI=1S/C14H22N4O3/c1-2-3-4-5-6-11-9-18(17-16-11)10-13(19)15-12-7-8-21-14(12)20/h9,12H,2-8,10H2,1H3,(H,15,19)/t12-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
KEGG
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 4.25E+5n/an/an/an/an/an/a



Technical University of Denmark

Curated by ChEMBL


Assay Description
Antagonist activity at lasB in Pseudomonas aeruginosa harboring lasB-gfp gene assessed as inhibition of 3-oxo-C6-HSL-induced quorum sensing by green ...


Bioorg Med Chem 23: 1638-50 (2015)


Article DOI: 10.1016/j.bmc.2015.01.038
BindingDB Entry DOI: 10.7270/Q2F192P6
More data for this
Ligand-Target Pair