CHEMBL228911
| SMILES | OC1(c2ccccc2)CCN(C(c2ccccc2Cl)c2ccccc2Cl)CC1 |
| InChIKey | VYRHTEGFBOSTMB-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 2 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 4 |
| Molecular weight (Da) | 411.1 |
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 | 5.78 | 5.78 | 5.78 | ChEMBL |
| κ | OPRK | Human | Opioid | A | pKi | 6.2 | 6.2 | 6.2 | ChEMBL |
| μ | OPRM | Human | Opioid | A | pKi | 6.59 | 6.59 | 6.59 | ChEMBL |
| NOP | OPRX | Human | Opioid | A | pKi | 8.7 | 8.7 | 8.7 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| NOP | OPRX | Human | Opioid | A | pEC50 | 6.65 | 6.65 | 6.65 | ChEMBL |