CHEMBL2204029
| SMILES | CN1CC[C@]23c4c5ccc(O)c4O[C@H]2[C@]2(CC[C@@]3(O)[C@H]1C5)O[C@@H]1CO[C@@H]3CO[C@H]2N31 |
| InChIKey | DQEHLNVSKKYQIF-DBODFUHTSA-N |
Chemical properties
| Hydrogen bond acceptors | 8 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 0 |
| Molecular weight (Da) | 414.2 |
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 | 8.63 | 8.63 | 8.63 | ChEMBL |
| δ | OPRD | Mouse | Opioid | A | pKi | 6.77 | 6.77 | 6.77 | ChEMBL |
| κ | OPRK | Guinea pig | Opioid | A | pKi | 6.96 | 6.96 | 6.96 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |