O-DESMETHYL TRAMADOL
SMILES | CN(C)C[C@H]1CCCC[C@]1(O)c1cccc(O)c1 |
InChIKey | UWJUQVWARXYRCG-HIFRSBDPSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 2 |
Rotatable bonds | 3 |
Molecular weight (Da) | 249.2 |
Drug properties
Molecular type | Small molecule |
Endogenous/Surrogate | Surrogate |
Approved drug | No |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
μ | OPRM | Rat | Opioid | A | pKi | 7.89 | 7.89 | 7.89 | ChEMBL |
δ | OPRD | Human | Opioid | A | pKi | 5.54 | 5.54 | 5.54 | ChEMBL |
κ | OPRK | Human | Opioid | A | pKi | 6.35 | 6.35 | 6.35 | ChEMBL |
μ | OPRM | Human | Opioid | A | pKi | 7.89 | 7.97 | 8.07 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
μ | OPRM | Rat | Opioid | A | pEC50 | 6.61 | 6.61 | 6.61 | ChEMBL |
μ | OPRM | Human | Opioid | A | pIC50 | 7.33 | 7.34 | 7.37 | ChEMBL |
μ | OPRM | Human | Opioid | A | pEC50 | 6.62 | 6.77 | 6.92 | ChEMBL |