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Compile Data Set for Download or QSAR

Found 1 hit of ec50 for monomerid = 50055072   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50055072
PNG
(CHEMBL3323520)
Show SMILES CC(=O)N1CCN(C2C(CCCC12)N1CCCC1)C(=O)Cc1ccc(Cl)c(Cl)c1
Show InChI InChI=1/C22H29Cl2N3O2/c1-15(28)26-11-12-27(21(29)14-16-7-8-17(23)18(24)13-16)22-19(5-4-6-20(22)26)25-9-2-3-10-25/h7-8,13,19-20,22H,2-6,9-12,14H2,1H3
PDB

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Article
PubMed
n/an/an/an/a 330n/an/an/an/a



Westf£lische Wilhelms-Universit£t M£nster

Curated by ChEMBL


Assay Description
Agonist activity at human kappa opioid receptor expressed in HEK-293 cells assessed as stimulation of [35S]-GTPgammaS binding after 30 mins by liquid...


J Med Chem 57: 6845-60 (2014)


Article DOI: 10.1021/jm500940q
BindingDB Entry DOI: 10.7270/Q2G73GDP
More data for this
Ligand-Target Pair