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SMILES: Oc1ccc2CC3C4CCCC[C@]4(CCN3CCC#N)c2c1

InChI Key: InChIKey=UQZSBBAXTQOIMR-NKELODKYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50496887   
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
Delta-type/Kappa-type/Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50496887
PNG
(CHEMBL3228707)
Show SMILES Oc1ccc2CC3C4CCCC[C@]4(CCN3CCC#N)c2c1 |r,TLB:16:15:4.20.5:7|
Show InChI InChI=1S/C19H24N2O/c20-9-3-10-21-11-8-19-7-2-1-4-16(19)18(21)12-14-5-6-15(22)13-17(14)19/h5-6,13,16,18,22H,1-4,7-8,10-12H2/t16?,18?,19-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a>1.00E+5n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity to opiate receptor in rat brain homogenates


J Med Chem 22: 328-31 (1979)


Article DOI: 10.1021/jm00189a024
BindingDB Entry DOI: 10.7270/Q2GH9MX3
More data for this
Ligand-Target Pair
Delta-type/Kappa-type/Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50496887
PNG
(CHEMBL3228707)
Show SMILES Oc1ccc2CC3C4CCCC[C@]4(CCN3CCC#N)c2c1 |r,TLB:16:15:4.20.5:7|
Show InChI InChI=1S/C19H24N2O/c20-9-3-10-21-11-8-19-7-2-1-4-16(19)18(21)12-14-5-6-15(22)13-17(14)19/h5-6,13,16,18,22H,1-4,7-8,10-12H2/t16?,18?,19-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 1.5n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity to opiate receptor in rat brain homogenates


J Med Chem 22: 328-31 (1979)


Article DOI: 10.1021/jm00189a024
BindingDB Entry DOI: 10.7270/Q2GH9MX3
More data for this
Ligand-Target Pair