CHEMBL1169583
SMILES | CO[C@H](C)[C@@H]1CC23C=C[C@]1(OC)[C@H]1Oc4c(O)ccc5c4C12CCN(C)C3C5 |
InChIKey | DRJFACWZQYBMLO-LYSZIEQMSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 3 |
Molecular weight (Da) | 383.2 |
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 | 7.89 | 7.89 | 7.89 | ChEMBL |
μ | OPRM | Human | Opioid | A | pKi | 8.8 | 8.8 | 8.8 | ChEMBL |
κ | OPRK | Human | Opioid | A | pKi | 8.41 | 8.41 | 8.41 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
δ | OPRD | Human | Opioid | A | pEC50 | 7.43 | 7.43 | 7.43 | ChEMBL |
μ | OPRM | Human | Opioid | A | pEC50 | 7.79 | 7.79 | 7.79 | ChEMBL |
κ | OPRK | Human | Opioid | A | pEC50 | 7.74 | 7.74 | 7.74 | ChEMBL |