CHEMBL218520
SMILES | C[C@H]1CN2C[C@H](c3ccccc3)N(C)C[C@H]2C[C@@]1(C)c1cccc(O)c1 |
InChIKey | KFASSAPEPBYWOW-RMVZNSSTSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 1 |
Rotatable bonds | 2 |
Molecular weight (Da) | 350.2 |
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 | 5.64 | 5.89 | 6.14 | ChEMBL |
κ | OPRK | Human | Opioid | A | pKi | 7.89 | 7.9 | 7.92 | ChEMBL |
μ | OPRM | Human | Opioid | A | pKi | 8.48 | 8.48 | 8.48 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
δ | OPRD | Human | Opioid | A | pIC50 | 6.24 | 6.24 | 6.24 | ChEMBL |
κ | OPRK | Human | Opioid | A | pIC50 | 8.62 | 8.62 | 8.62 | ChEMBL |
μ | OPRM | Human | Opioid | A | pIC50 | 7.58 | 7.58 | 7.58 | ChEMBL |