nabilone
SMILES | CCCCCCC(c1cc(O)c2c(c1)OC(C1C2CC(=O)CC1)(C)C)(C)C |
InChIKey | GECBBEABIDMGGL-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 1 |
Rotatable bonds | 6 |
Molecular weight (Da) | 372.3 |
Drug properties
Molecular type | Small molecule |
Endogenous/Surrogate | Surrogate |
Approved drug | Yes |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
δ | OPRD | Human | Opioid | A | pKi | 8.25 | 8.25 | 8.25 | ChEMBL |
κ | OPRK | Human | Opioid | A | pKi | 9.85 | 9.85 | 9.85 | ChEMBL |
μ | OPRM | Human | Opioid | A | pKi | 8.34 | 8.34 | 8.34 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
δ | OPRD | Human | Opioid | A | pEC50 | 7.14 | 7.14 | 7.14 | ChEMBL |
κ | OPRK | Human | Opioid | A | pEC50 | 8.47 | 8.47 | 8.47 | ChEMBL |
μ | OPRM | Human | Opioid | A | pEC50 | 7.82 | 7.82 | 7.82 | ChEMBL |