CHEMBL237295
| SMILES | NC(=O)c1ccc(Oc2ccc(CCN3CCc4ccccc4C3)cc2)nc1 |
| InChIKey | RAFLIAKPWNTXKX-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 6 |
| Molecular weight (Da) | 373.2 |
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 |
| δ | OPRD | Human | Opioid | A | pKi | 6.84 | 6.84 | 6.84 | ChEMBL |
| κ | OPRK | Human | Opioid | A | pKi | 6.73 | 6.73 | 6.73 | ChEMBL |
| δ | OPRD | Human | Opioid | A | pKi | 6.84 | 6.84 | 6.84 | PDSP Ki database |
| κ | OPRK | Human | Opioid | A | pKi | 6.73 | 6.73 | 6.73 | PDSP Ki database |
| μ | OPRM | Human | Opioid | A | pKi | 8.3 | 8.3 | 8.3 | PDSP Ki database |
| μ | OPRM | Human | Opioid | A | pKi | 8.3 | 8.3 | 8.3 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |