CHEMBL4591528
| SMILES | NC(=O)c1cccc([C@@H]2C[C@@H]3CC[C@H](C2)N3CCN(CC2CCOCC2)C(=O)CO)c1 |
| InChIKey | CIANKZFHYOIKRY-KOUNCHBCSA-N |
Chemical properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 8 |
| Molecular weight (Da) | 429.3 |
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 | 8.2 | 8.2 | 8.2 | ChEMBL |
| δ | OPRD | Human | Opioid | A | pKi | 6.7 | 6.7 | 6.7 | ChEMBL |
| μ | OPRM | Human | Opioid | A | pKi | 7.9 | 7.9 | 7.9 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |