ethylketocyclazocine
| SMILES | CC[C@@]12CCN([C@H]([C@H]1C)C(=O)c1c2cc(O)cc1)CC1CC1 |
| InChIKey | SEJUQQOPVAUETF-QHLBDZCJSA-N |
Chemical properties
| Hydrogen bond acceptors | 3 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 3 |
| Molecular weight (Da) | 299.2 |
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 | 8.5 | 8.5 | 8.5 | Guide to Pharmacology |
| κ | OPRK | Human | Opioid | A | pKi | 10.0 | 10.0 | 10.0 | Guide to Pharmacology |
| κ | OPRK | Human | Opioid | A | pKd | 9.4 | 9.4 | 9.4 | Guide to Pharmacology |
| μ | OPRM | Human | Opioid | A | pKi | 9.5 | 9.5 | 9.5 | Guide to Pharmacology |
| κ | OPRK | Rat | Opioid | A | pKi | 8.8 | 8.8 | 8.8 | Guide to Pharmacology |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| δ | OPRD | Mouse | Opioid | A | pIC50 | 6.2 | 6.2 | 6.2 | Guide to Pharmacology |
| κ | OPRK | Mouse | Opioid | A | pIC50 | 9.0 | 9.0 | 9.0 | Guide to Pharmacology |