CHEMBL4594673
SMILES | CCOc1ccc(CN2CCc3ccccc3C2)cc1CNC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C |
InChIKey | OVWAZDSWAVPPTQ-NDEPHWFRSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 3 |
Rotatable bonds | 9 |
Molecular weight (Da) | 487.3 |
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 |
δ | OPRD | Human | Opioid | A | pKi | 8.62 | 8.62 | 8.62 | ChEMBL |
κ | OPRK | Human | Opioid | A | pKi | 7.36 | 7.36 | 7.36 | ChEMBL |
μ | OPRM | Human | Opioid | A | pKi | 9.64 | 9.64 | 9.64 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
μ | OPRM | Human | Opioid | A | pEC50 | 8.72 | 8.72 | 8.72 | ChEMBL |