CHEMBL518712
| SMILES | C[C@H]1C2Cc3cc4nc[nH]c4cc3[C@@]1(C)CCN2CC1CC1 |
| InChIKey | UOWGKJIQQSGDIA-NNZWLKQRSA-N |
Chemical properties
| Hydrogen bond acceptors | 2 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 2 |
| Molecular weight (Da) | 295.2 |
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 | 8.29 | 8.29 | 8.29 | ChEMBL |
| κ | OPRK | Human | Opioid | A | pKi | 10.2 | 10.2 | 10.2 | ChEMBL |
| μ | OPRM | Human | Opioid | A | pKi | 9.51 | 9.51 | 9.51 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| κ | OPRK | Human | Opioid | A | pEC50 | 8.33 | 8.33 | 8.33 | ChEMBL |
| μ | OPRM | Human | Opioid | A | pEC50 | 8.01 | 8.01 | 8.01 | ChEMBL |
| μ | OPRM | Human | Opioid | A | pIC50 | 6.77 | 6.77 | 6.77 | ChEMBL |