17-cyclobutylmethyl-(1R,9R)-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-4-ol
| SMILES | C1CCC23CCN(C(C2C1)CC4=C3C=C(C=C4)O)CC5CCC5 |
| InChIKey | YSTAPDGDOHWKQR-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 2 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 2 |
| Molecular weight (Da) | 311.2 |
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 | 8.23 | 8.23 | 8.23 | PDSP Ki database |
| κ | OPRK | Human | Opioid | A | pKi | 10.1 | 10.1 | 10.1 | PDSP Ki database |
| μ | OPRM | Human | Opioid | A | pKi | 9.64 | 9.64 | 9.64 | PDSP Ki database |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |