rel-(2R,6R,11R)-6,11-Dimethyl-3-(3-methyl-but-2-enyl)-1,2,3,4,5,6-hexahydro-2,6-methano-benzo[d]azocine-8-carboxylic acid amide
SMILES | CC1C2CC3=C(C1(CCN2CC=C(C)C)C)C=C(C=C3)C(=O)N |
InChIKey | ASEDTRKYKLTHTA-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 2 |
Hydrogen bond donors | 1 |
Rotatable bonds | 3 |
Molecular weight (Da) | 312.2 |
Drug properties
Molecular type | Small molecule |
Endogenous/Surrogate | Surrogate |
Approved drug | No |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
δ | OPRD | Human | Opioid | A | pKi | 6.66 | 6.66 | 6.66 | PDSP Ki database |
κ | OPRK | Human | Opioid | A | pKi | 8.25 | 8.25 | 8.25 | PDSP Ki database |
μ | OPRM | Human | Opioid | A | pKi | 8.28 | 8.28 | 8.28 | PDSP Ki database |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |