CHEMBL511884
| SMILES | CC1C2Cc3ccc(C(N)=O)cc3C1(C)CCN2C |
| InChIKey | QQRJMFPSTOYARH-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 2 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 1 |
| Molecular weight (Da) | 258.2 |
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 | 6.5 | 6.5 | 6.5 | ChEMBL |
| κ | OPRK | Human | Opioid | A | pKi | 7.72 | 7.72 | 7.72 | ChEMBL |
| μ | OPRM | Human | Opioid | A | pKi | 8.8 | 8.8 | 8.8 | ChEMBL |
| μ | OPRM | Human | Opioid | A | pKi | 8.8 | 8.8 | 8.8 | PDSP Ki database |
| δ | OPRD | Human | Opioid | A | pKi | 6.49 | 6.49 | 6.49 | PDSP Ki database |
| κ | OPRK | Human | Opioid | A | pKi | 7.72 | 7.72 | 7.72 | PDSP Ki database |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| μ | OPRM | Human | Opioid | A | pIC50 | 7.6 | 7.6 | 7.6 | ChEMBL |
| μ | OPRM | Human | Opioid | A | pEC50 | 7.62 | 7.62 | 7.62 | ChEMBL |