CHEMBL3397593
| SMILES | CC(C)[C@@H](CN1CC[C@@](C)(c2cccc(O)c2)[C@@H](C)C1)NC(=O)[C@H]1Cc2ccc(O)cc2CN1CCF |
| InChIKey | IGCXZQHAUNGWFU-XNCYAKTISA-N |
Chemical properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 3 |
| Rotatable bonds | 8 |
| Molecular weight (Da) | 511.3 |
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 | Rat | Opioid | A | pKi | 8.26 | 8.26 | 8.26 | ChEMBL |
| δ | OPRD | Human | Opioid | A | pKi | 7.14 | 7.14 | 7.14 | ChEMBL |
| μ | OPRM | Human | Opioid | A | pKi | 7.88 | 7.88 | 7.88 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |