levallorphan
| SMILES | C=CCN1CC[C@@]23[C@H]([C@H]1Cc1c3cc(cc1)O)CCCC2 |
| InChIKey | OZYUPQUCAUTOBP-QXAKKESOSA-N |
Chemical properties
| Hydrogen bond acceptors | 2 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 2 |
| Molecular weight (Da) | 283.2 |
Drug properties
| Molecular type | Small molecule |
| Physiological/Surrogate | Surrogate |
| Approved drug | Yes |
Database connections
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| μ | OPRM | Human | Opioid | A | pKi | 8.77 | 8.99 | 9.32 | ChEMBL |
| μ | OPRM | Rat | Opioid | A | pKi | 8.7 | 9.12 | 9.67 | PDSP Ki database |
| δ | OPRD | Rat | Opioid | A | pKi | 8.66 | 8.66 | 8.66 | PDSP Ki database |
| μ | OPRM | Human | Opioid | A | pKi | 8.03 | 8.03 | 8.03 | Drug Central |
| μ | OPRM | Human | Opioid | A | pKi | 8.77 | 9.05 | 9.32 | Guide to Pharmacology |
| κ | OPRK | Rat | Opioid | A | pKi | 5.96 | 5.96 | 5.96 | PDSP Ki database |
| μ | OPRM | Mouse | Opioid | A | pKi | 9.01 | 9.02 | 9.02 | PDSP Ki database |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| μ | OPRM | Rat | Opioid | A | pIC50 | 9.2 | 9.2 | 9.2 | ChEMBL |
| μ | OPRM | Rat | Opioid | A | pIC50 | 8.04 | 8.04 | 8.04 | Drug Central |