CHEMBL1169582
| SMILES | CO[C@@H](C)[C@@H]1CC23C=C[C@]1(OC)[C@H]1Oc4c(O)ccc5c4C12CCN(C)C3C5 |
| InChIKey | DRJFACWZQYBMLO-CDTUDGABSA-N |
Chemical properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 3 |
| Molecular weight (Da) | 383.2 |
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 |
| δ | OPRD | Human | Opioid | A | pKi | 7.11 | 7.11 | 7.11 | ChEMBL |
| κ | OPRK | Human | Opioid | A | pKi | 7.36 | 7.36 | 7.36 | ChEMBL |
| μ | OPRM | Human | Opioid | A | pKi | 8.32 | 8.32 | 8.32 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| δ | OPRD | Human | Opioid | A | pEC50 | 6.8 | 6.8 | 6.8 | ChEMBL |
| κ | OPRK | Human | Opioid | A | pEC50 | 6.79 | 6.79 | 6.79 | ChEMBL |
| μ | OPRM | Human | Opioid | A | pEC50 | 7.46 | 7.46 | 7.46 | ChEMBL |