(-)-trans-9-Methoxy-3-(2-phenylethyl)-2,3,4,4aalpha,5,6,7,7aalpha-octahydro-1H-benzo[4,5]furo[3,2-e]isoquinoline
| SMILES | COC1=CC=CC2=C1OC3C24CCN(CC4CCC3)CCC5=CC=CC=C5 |
| InChIKey | HVQROFSHEXGBAM-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 3 |
| Hydrogen bond donors | 0 |
| Rotatable bonds | 4 |
| Molecular weight (Da) | 363.2 |
Drug properties
| Molecular type | Small molecule |
| Physiological/Surrogate | Surrogate |
| Approved drug | No |
Database connections
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| κ | OPRK | Human | Opioid | A | pKi | 5.73 | 5.84 | 5.94 | PDSP Ki database |
| δ | OPRD | Human | Opioid | A | pKi | 5.08 | 5.7 | 6.31 | PDSP Ki database |
| μ | OPRM | Human | Opioid | A | pKi | 6.84 | 7.23 | 7.62 | PDSP Ki database |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |