CHEMBL257139
SMILES | CN(C(=O)Cc1cc2c(cc1S(=O)(=O)N(C)C)OCO2)[C@H](CN1CC[C@H](O)C1)c1ccccc1 |
InChIKey | QHBZVLDXKCSSNW-VQTJNVASSA-N |
Chemical properties
Hydrogen bond acceptors | 7 |
Hydrogen bond donors | 1 |
Rotatable bonds | 8 |
Molecular weight (Da) | 489.2 |
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 | 8.21 | 8.21 | 8.21 | ChEMBL |
κ | OPRK | Human | Opioid | A | pKi | 9.27 | 9.27 | 9.27 | ChEMBL |
μ | OPRM | Human | Opioid | A | pKi | 7.47 | 7.47 | 7.47 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
κ | OPRK | Human | Opioid | A | pEC50 | 9.96 | 9.96 | 9.96 | ChEMBL |