Ligand Data
Ligand
| Name | CHEMBL27432 |
| SMILES | CCN(CC)C(=O)c1ccc(C(c2ccccc2)N2CCN(CC3CCc4ccccc4C3)CC2)cc1 |
| InChIKey | QXAWSSWYWHHUAE-UHFFFAOYSA-N |
| Type | small-molecule |
| External Links |
Structure
Properties
| Hydrogen bond acceptors | 3 |
| Hydrogen bond donors | 0 |
| Rotatable bonds | 8 |
| Molecular weight | 495.3 |
Bioactivity
| Receptor | Affinity (nM) | Potency (nM) | ||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Min | Avg | Max | Min | Avg | Max |
| μ | OPRM | Rat | Opioid | A (Rhodopsin) | 6236 | 6236 | 6236 | |||
| δ | OPRD | Human | Opioid | A (Rhodopsin) | 1.8 | 1.8 | 1.8 | |||