CHEMBL611438
| SMILES | CN1CC[C@]23c4c5ccc(O)c4O[C@H]2c2ncc(-c4ccc(Cl)cc4)cc2C[C@@]3(O)[C@H]1C5 |
| InChIKey | YMQBQNZSHDBDTL-IFKAHUTRSA-N |
Chemical properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 1 |
| Molecular weight (Da) | 446.1 |
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 | Guinea pig | Opioid | A | pKi | 6.33 | 6.33 | 6.33 | ChEMBL |
| μ | OPRM | Rat | Opioid | A | pKi | 6.64 | 6.64 | 6.64 | ChEMBL |
| δ | OPRD | Human | Opioid | A | pKi | 8.41 | 8.41 | 8.41 | ChEMBL |
| κ | OPRK | Human | Opioid | A | pKi | 6.33 | 6.33 | 6.33 | ChEMBL |
| μ | OPRM | Human | Opioid | A | pKi | 6.64 | 6.64 | 6.64 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |