CHEMBL112035
| SMILES | CN1CCC23c4c5ccc(O)c4OC2c2n[nH]cc2CC3(O)C1C5 |
| InChIKey | VGCJASRZUDMBDW-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 3 |
| Rotatable bonds | 0 |
| Molecular weight (Da) | 325.1 |
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 | 7.91 | 7.91 | 7.91 | ChEMBL |
| κ | OPRK | Human | Opioid | A | pKi | 7.92 | 7.92 | 7.92 | ChEMBL |
| μ | OPRM | Human | Opioid | A | pKi | 8.76 | 8.76 | 8.76 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| δ | OPRD | Human | Opioid | A | pEC50 | 7.6 | 7.6 | 7.6 | ChEMBL |
| μ | OPRM | Human | Opioid | A | pEC50 | 7.71 | 7.71 | 7.71 | ChEMBL |