CHEMBL2016672
| SMILES | Oc1ccc2c3c1O[C@@H]1[C@]34CCN(CC3CC3)[C@H](C2)[C@]42CC[C@@]1(O)CO2 |
| InChIKey | NOOSMRUESWMKBO-VHQPJYBDSA-N |
Chemical properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 2 |
| Molecular weight (Da) | 355.2 |
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 |
| μ | OPRM | Mouse | Opioid | A | pKi | 9.39 | 9.39 | 9.39 | ChEMBL |
| δ | OPRD | Mouse | Opioid | A | pKi | 8.03 | 8.03 | 8.03 | ChEMBL |
| κ | OPRK | Guinea pig | Opioid | A | pKi | 9.33 | 9.33 | 9.33 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |