(-)-trans-3-(2-Phenylethyl)-2,3,4,4aalpha,5,6,7,7aalpha-octahydro-1Hbenzo[4,5]furo[3,2-e]isoquinolin-9-ol
| SMILES | C1CC2CN(CCC23C(C1)OC4=C3C=CC=C4O)CCC5=CC=CC=C5 |
| InChIKey | ZGRGUZOYNFJORG-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 3 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 3 |
| Molecular weight (Da) | 349.2 |
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 | 5.91 | 6.87 | 7.82 | PDSP Ki database |
| μ | OPRM | Human | Opioid | A | pKi | 6.56 | 8.04 | 9.52 | PDSP Ki database |
| δ | OPRD | Human | Opioid | A | pKi | 5.3 | 6.76 | 8.22 | PDSP Ki database |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |