Chembl339254
Chemical Properties
| SMILES | COc1ccc(C[C@@H]2CN3C(=NC[C@@H]3C)N2CCC2CC3CCC2C3)cc1 |
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 0 |
| Rotatable bonds | 6 |
| Molecular weight | 367.3 |
Drug Properties
| Type | Small molecule |
| Endogenous | No |
| Approved | No |
| InChIKey | VQKLFYFQQYOFJU-QOFAJKBSSA-N |
Bioactivity
| Receptor | Experimental Data | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| κ | OPRK | Guinea pig | Opioid | A | pIC50 | 7.07 | 7.07 | 7.07 | ChEMBL |
| δ | OPRD | Human | Opioid | A | pIC50 | 5.68 | 5.68 | 5.68 | ChEMBL |
| κ | OPRK | Human | Opioid | A | pIC50 | 7.07 | 7.07 | 7.07 | ChEMBL |
| μ | OPRM | Human | Opioid | A | pIC50 | 4.69 | 4.69 | 4.69 | ChEMBL |