CHEMBL575508
SMILES | CC(C)[C@@H](CN1CC[C@@](C)(c2cccc(O)c2)[C@@H](C)C1)NC(=O)[C@H]1Cc2ccc(O)cc2CN1C |
InChIKey | OHIFKDNMHSXJFA-XAOJMSMDSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 3 |
Rotatable bonds | 6 |
Molecular weight (Da) | 479.3 |
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 | Guinea pig | Opioid | A | pKi | 10.28 | 10.28 | 10.28 | ChEMBL |
μ | OPRM | Rat | Opioid | A | pKi | 7.43 | 7.43 | 7.43 | ChEMBL |
δ | OPRD | Human | Opioid | A | pKi | 6.93 | 6.93 | 6.93 | ChEMBL |
κ | OPRK | Human | Opioid | A | pKi | 9.0 | 9.41 | 9.81 | ChEMBL |
μ | OPRM | Human | Opioid | A | pKi | 7.51 | 7.78 | 8.05 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |