CHEMBL114803
| SMILES | CN1CCC23c4c5ccc(O)c4OC2c2nc(O)ncc2CC3(O)C1C5 |
| InChIKey | LCNCABZWEXDLGV-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 7 |
| Hydrogen bond donors | 3 |
| Rotatable bonds | 0 |
| Molecular weight (Da) | 353.1 |
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 | 7.72 | 7.72 | 7.72 | ChEMBL |
| κ | OPRK | Human | Opioid | A | pKi | 7.91 | 7.91 | 7.91 | ChEMBL |
| μ | OPRM | Human | Opioid | A | pKi | 8.43 | 8.43 | 8.43 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| δ | OPRD | Human | Opioid | A | pEC50 | 7.21 | 7.21 | 7.21 | ChEMBL |
| κ | OPRK | Human | Opioid | A | pEC50 | 5.99 | 5.99 | 5.99 | ChEMBL |
| μ | OPRM | Human | Opioid | A | pEC50 | 6.96 | 6.96 | 6.96 | ChEMBL |