tapentadol
SMILES | CC[C@@H](c1cccc(c1)O)[C@H](CN(C)C)C |
InChIKey | KWTWDQCKEHXFFR-SMDDNHRTSA-N |
Chemical properties
Hydrogen bond acceptors | 2 |
Hydrogen bond donors | 1 |
Rotatable bonds | 5 |
Molecular weight (Da) | 221.2 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | Yes |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
μ | OPRM | Human | Opioid | A | pKi | 6.8 | 6.8 | 6.8 | Guide to Pharmacology |
μ | OPRM | Human | Opioid | A | pKi | 6.8 | 6.8 | 6.8 | ChEMBL |
μ | OPRM | Human | Opioid | A | pKi | 8.15 | 8.15 | 8.15 | Drug Central |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
μ | OPRM | Human | Opioid | A | pEC50 | 6.17 | 6.17 | 6.17 | ChEMBL |