Brief Information of the Compound and Protein
Compound Name
 Compound Info 
(1S,2S,13R,21R)-22-(cyclopropylmethyl)-14-oxa-11,22-diazaheptacyclo[13.9.1.01,13.02,21.04,12.05,10.019,25]pentacosa-4(12),5,7,9,15,17,19(25)-heptaene-2,16-diol
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 PubChem ID
CID: 5497186
SID: 14806612
Canonical SMILES
Oc1ccc2C[C@H]3N(CC4CC4)CC[C@@]45[C@@H](Oc1c24)c1[nH]c2ccccc2c1C[C@@]35O
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Compound Formula C26H26N2O3
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
CL000011 CHO
 Cell Line Info 
Cricetulus griseus (Chinese hamster)  10
1
IC50 = 0.39 nM
   TI
   LI
   LO
   TS
2
IC50 < 0.51 nM
   TI
   LI
   LO
   TS
3
Kd = 11.22 nM
   TI
   LI
   LO
   TS
4
Ki = 0.1072 nM
   TI
   LI
   LO
   TS
5
Ki = 0.14 nM
   TI
   LI
   LO
   TS
6
Ki = 0.2 nM
   TI
   LI
   LO
   TS
7
Ki = 0.457 nM
   TI
   LI
   LO
   TS
8
Ki = 0.46 nM
   TI
   LI
   LO
   TS
9
Ki = 0.5 nM
   TI
   LI
   LO
   TS
10
Ki = 1.97 nM
   TI
   LI
   LO
   TS
CL000025 HEK-293T
 Cell Line Info 
Homo sapiens (Human)  1
1
Ki = 0.9 nM
   TI
   LI
   LO
   TS
CL000006 HEK293
 Cell Line Info 
Homo sapiens (Human)  2
1
IC50 = 0.91 nM
   TI
   LI
   LO
   TS
2
Ki = 0.16 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 Ki = 0.062 nM
2 Ki = 0.07 nM
3 Ki = 0.15 nM
4 Ki = 0.16 nM
5 Ki = 0.22 nM
6 Ki = 0.24 nM
7 Ki = 0.9 nM
8 Ki = 2.53 nM