CHEMBL4065490
| SMILES | CO[C@@]12CCC[C@@H]3Oc4c(O)ccc5c4[C@@]31CCN(C)[C@@H]2C5 |
| InChIKey | RBHBHDMQEQBLQT-LTCOOKNTSA-N |
Chemical properties
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 1 |
| Molecular weight (Da) | 301.2 |
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 | 8.06 | 8.06 | 8.06 | ChEMBL |
| κ | OPRK | Human | Opioid | A | pKi | 8.4 | 8.4 | 8.4 | ChEMBL |
| μ | OPRM | Human | Opioid | A | pKi | 9.62 | 9.62 | 9.62 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| μ | OPRM | Human | Opioid | A | pEC50 | 8.86 | 8.86 | 8.86 | ChEMBL |