CHEMBL1834410
| SMILES | CO[C@]12CC[C@@]3(C[C@@H]1[C@](C)(O)CC(C)(C)C)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5 |
| InChIKey | RIMTXZIUOVDSSA-JLXZXSBASA-N |
Chemical properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 5 |
| Molecular weight (Da) | 481.3 |
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 |
| NOP | OPRX | Human | Opioid | A | pKi | 7.73 | 7.73 | 7.73 | ChEMBL |
| δ | OPRD | Human | Opioid | A | pKi | 8.9 | 8.9 | 8.9 | ChEMBL |
| κ | OPRK | Human | Opioid | A | pKi | 8.8 | 8.8 | 8.8 | ChEMBL |
| μ | OPRM | Human | Opioid | A | pKi | 8.53 | 8.53 | 8.53 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| δ | OPRD | Human | Opioid | A | pEC50 | 7.3 | 7.3 | 7.3 | ChEMBL |
| μ | OPRM | Human | Opioid | A | pEC50 | 8.59 | 8.59 | 8.59 | ChEMBL |