CHEMBL129693
| SMILES | CCN(CC)C(=O)c1ccc(C(=C2CCNCC2)c2ccc(SC)cc2)cc1 |
| InChIKey | IJHGFEFPIKWXTF-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 3 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 6 |
| Molecular weight (Da) | 394.2 |
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 |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| δ | OPRD | Human | Opioid | A | pEC50 | 7.63 | 7.63 | 7.63 | ChEMBL |
| δ | OPRD | Human | Opioid | A | pIC50 | 8.68 | 8.68 | 8.68 | ChEMBL |
| μ | OPRM | Human | Opioid | A | pIC50 | 5.17 | 5.17 | 5.17 | ChEMBL |