CHEMBL418080
SMILES | Cc1cc(O)cc(C)c1CC(N)C(=O)N1Cc2cc(-c3ccsc3)ccc2C[C@H]1C(=O)O |
InChIKey | XJUFWAWETNPMLY-WCSIJFPASA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 3 |
Rotatable bonds | 5 |
Molecular weight (Da) | 450.2 |
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 |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
δ | OPRD | Human | Opioid | A | pIC50 | 7.87 | 7.87 | 7.87 | ChEMBL |
κ | OPRK | Human | Opioid | A | pIC50 | 5.56 | 5.56 | 5.56 | ChEMBL |
μ | OPRM | Human | Opioid | A | pIC50 | 6.85 | 6.85 | 6.85 | ChEMBL |