CHEMBL4159603
SMILES | CN1CC[C@]23c4c5ccc(O)c4O[C@H]2[C@@H](NC(=O)c2ccncc2)C=C[C@H]3[C@H]1C5 |
InChIKey | QKFLNPYMNMJADC-NXASZBTQSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 2 |
Rotatable bonds | 2 |
Molecular weight (Da) | 389.2 |
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 |
κ | OPRK | Mouse | Opioid | A | pKi | 7.11 | 7.11 | 7.11 | ChEMBL |
μ | OPRM | Mouse | Opioid | A | pKi | 8.7 | 8.7 | 8.7 | ChEMBL |
δ | OPRD | Mouse | Opioid | A | pKi | 7.19 | 7.19 | 7.19 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
μ | OPRM | Mouse | Opioid | A | pEC50 | 8.34 | 8.34 | 8.34 | ChEMBL |