BDBM50189164 (2S,4aR,6aS,7R,9S,10aS)-7-((dimethylamino)methyl)-2-(furan-3-yl)-6a,10b-dimethyl-5,10-dioxo-dodecahydro-1H-benzo[f]isochromen-9-yl acetate::CHEMBL425249

SMILES CN(C)C[C@@H]1C[C@H](OC(C)=O)C(=O)[C@H]2[C@@]1(C)CC(=O)[C@H]1CO[C@@H](CC21C)c1ccoc1

InChI Key InChIKey=RUUVSDJOLFLHAT-UHFFFAOYSA-N

Data  1 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50189164   

TargetKappa-type opioid receptor(Human)
Mclean Hospital

Curated by ChEMBL
LigandPNGBDBM50189164((2S,4aR,6aS,7R,9S,10aS)-7-((dimethylamino)methyl)-...)
Affinity DataKi: >1.00E+4nMAssay Description:Inhibition of [3H]diprenorphine binding to human KOR expressed in CHO cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed