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SMILES: CN([C@@H]1CCCC[C@H]1N1CCCCCC1)C(=O)COc1cc(Cl)c(Cl)c(Cl)c1Cl

InChI Key: InChIKey=VPLIZQBJXWNKFX-HZPDHXFCSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50018771   
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
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50018771
PNG
(CHEMBL535801 | N-(2-Azepan-1-yl-cyclohexyl)-N-meth...)
Show SMILES CN([C@@H]1CCCC[C@H]1N1CCCCCC1)C(=O)COc1cc(Cl)c(Cl)c(Cl)c1Cl
Show InChI InChI=1S/C21H28Cl4N2O2/c1-26(15-8-4-5-9-16(15)27-10-6-2-3-7-11-27)18(28)13-29-17-12-14(22)19(23)21(25)20(17)24/h12,15-16H,2-11,13H2,1H3/t15-,16-/m1/s1
PDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
6.40n/an/an/an/an/an/an/an/a



Parke-Davis Research Unit

Curated by ChEMBL


Assay Description
Binding affinity for the Opioid receptor kappa 1


J Med Chem 31: 831-6 (1988)


BindingDB Entry DOI: 10.7270/Q2R78FSK
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)
BDBM50018771
PNG
(CHEMBL535801 | N-(2-Azepan-1-yl-cyclohexyl)-N-meth...)
Show SMILES CN([C@@H]1CCCC[C@H]1N1CCCCCC1)C(=O)COc1cc(Cl)c(Cl)c(Cl)c1Cl
Show InChI InChI=1S/C21H28Cl4N2O2/c1-26(15-8-4-5-9-16(15)27-10-6-2-3-7-11-27)18(28)13-29-17-12-14(22)19(23)21(25)20(17)24/h12,15-16H,2-11,13H2,1H3/t15-,16-/m1/s1
UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
720n/an/an/an/an/an/an/an/a



Parke-Davis Research Unit

Curated by ChEMBL


Assay Description
Binding affinity for the Opioid receptor mu 1


J Med Chem 31: 831-6 (1988)


BindingDB Entry DOI: 10.7270/Q2R78FSK
More data for this
Ligand-Target Pair