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BDBM50229959 CHEMBL152663

SMILES: [H][C@@]12CCC(=C)CC1(CCN(CC1CC1)C2)c1cccc(O)c1

InChI Key: InChIKey=UXZNWXSVNKTLLJ-LROBGIAVSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50229959   
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
Opioid receptors; mu/kappa/delta


(Homo sapiens (Human))
BDBM50229959
PNG
(CHEMBL152663)
Show SMILES Oc1cccc(c1)C12CCN(CC3CC3)C[C@@H]1CCC(=C)C2
Show InChI InChI=1S/C20H27NO/c1-15-5-8-18-14-21(13-16-6-7-16)10-9-20(18,12-15)17-3-2-4-19(22)11-17/h2-4,11,16,18,22H,1,5-10,12-14H2/t18-,20?/m0/s1
PDB

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a 15n/an/an/an/an/an/a



Glaxo Group Research Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against opioid receptor in Guinea pig ileum


J Med Chem 35: 48-56 (1992)


Article DOI: 10.1021/jm00079a005
BindingDB Entry DOI: 10.7270/Q2J105DC
More data for this
Ligand-Target Pair