CHEMBL3614060
| SMILES | CCC(=O)N(c1ccc(Cl)c(Cl)c1)C1CCN(Cc2ccc3c(c2)CCC[C@H]3N)CC1 |
| InChIKey | KGDWALBNHQCJOX-XMMPIXPASA-N |
Chemical properties
| Hydrogen bond acceptors | 3 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 5 |
| Molecular weight (Da) | 459.2 |
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 | 5.28 | 5.28 | 5.28 | ChEMBL |
| μ | OPRM | Rat | Opioid | A | pKi | 6.16 | 6.16 | 6.16 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| δ | OPRD | Human | Opioid | A | pIC50 | 4.71 | 4.71 | 4.71 | ChEMBL |
| μ | OPRM | Rat | Opioid | A | pIC50 | 5.92 | 5.92 | 5.92 | ChEMBL |