CHEMBL238282
| SMILES | CNC(=N)c1ccc(Oc2ccc(CNCCc3ccccc3)cc2)nc1 |
| InChIKey | VVCARAZTUNHWPO-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 3 |
| Rotatable bonds | 8 |
| Molecular weight (Da) | 360.2 |
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 | 5.46 | 5.46 | 5.46 | ChEMBL |
| μ | OPRM | Human | Opioid | A | pKi | 6.63 | 6.63 | 6.63 | ChEMBL |
| δ | OPRD | Human | Opioid | A | pKi | 5.46 | 5.46 | 5.46 | PDSP Ki database |
| κ | OPRK | Human | Opioid | A | pKi | 5.3 | 5.3 | 5.3 | PDSP Ki database |
| μ | OPRM | Human | Opioid | A | pKi | 6.63 | 6.63 | 6.63 | PDSP Ki database |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |