Brief Information of the Compound and Protein
Compound Name
 Compound Info 
(4S,7S,13S)-13-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-7-benzyl-3,3,14,14-tetramethyl-6,9,12-trioxo-1,2-dithia-5,8,11-triazacyclotetradecane-4-carboxylic acid
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 PubChem ID
CID: 104787
SID: 15459035
Canonical SMILES
CC1(C)SSC(C)(C)[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(=O)NCC(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H]1C(O)=O
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Compound Formula C30H39N5O7S2
Compound Structure
Protein Name
 Protein Info 
Delta-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
P41143
Gene Name
OPRD1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000064 Chem-1
 Cell Line Info 
Rattus norvegicus (Rat)  1
1
Ki = 1.32 nM
   TI
   LI
   LO
   TS
CL000011 CHO
 Cell Line Info 
Cricetulus griseus (Chinese hamster)  7
1
EC50 = 0.12 nM
   TI
   LI
   LO
   TS
2
EC50 = 8.01 nM
   TI
   LI
   LO
   TS
3
EC50 = 16.98 nM
   TI
   LI
   LO
   TS
4
EC50 = 26.92 nM
   TI
   LI
   LO
   TS
5
IC50 = 1.3 nM
   TI
   LI
   LO
   TS
6
Ki = 1.7 nM
   TI
   LI
   LO
   TS
7
Ki = 2.4 nM
   TI
   LI
   LO
   TS
CL000006 HEK293
 Cell Line Info 
Homo sapiens (Human)  4
1
IC50 = 0.3 nM
   TI
   LI
   LO
   TS
2
IC50 = 1.6 nM
   TI
   LI
   LO
   TS
3
Ki = 3.3 nM
   TI
   LI
   LO
   TS
4
Ki = 57.1 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 Ki = 3.2 nM