Brief Information of the Compound and Protein
Compound Name
(2S)-N-[(1S)-2-[[(1S)-2-amino-1-benzyl-2-oxo-ethyl]amino]-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]-1-[(2S)-2-(2-aminodecanoylamino)-3-(4-hydroxy-2,6-dimethyl-phenyl)propanoyl]pyrrolidine-2-carboxamide
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PubChem ID
CID: 168290722
Canonical SMILES
CCCCCCCCC(N)C(=O)N[C@@H](Cc1c(C)cc(O)cc1C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
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Compound Formula C46H61N7O6
Compound Structure
Protein Name
Mu-type opioid receptor
Protein Classification
Membrane receptor
>
Family A G protein-coupled receptor
>
Peptide receptor (family A GPCR)
>
Short peptide receptor (family A GPCR)
>
Opioid receptor
Uniprot ID
P35372
Gene Name
OPRM1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000004 SH-SY5Y Homo sapiens (Human)  2
1
EC50 = 1.3 nM
   TI
   LI
   LO
   TS
2
Ki = 0.47 nM
   TI
   LI
   LO
   TS