CHEMBL3325715
| SMILES | Cc1nn(-c2ccc(Cl)cc2Br)c2c1C(=O)CC(C)(C)C2 |
| InChIKey | FBBHGPDDCYKEJF-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 3 |
| Hydrogen bond donors | 0 |
| Rotatable bonds | 1 |
| Molecular weight (Da) | 366.0 |
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 |
| μ | OPRM | Rat | Opioid | A | pKi | 6.21 | 6.21 | 6.21 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| δ | OPRD | Human | Opioid | A | pIC50 | 5.47 | 5.47 | 5.47 | ChEMBL |
| κ | OPRK | Human | Opioid | A | pIC50 | 6.24 | 6.24 | 6.24 | ChEMBL |
| μ | OPRM | Human | Opioid | A | pEC50 | 7.0 | 7.2 | 7.39 | ChEMBL |
| μ | OPRM | Human | Opioid | A | pIC50 | 5.48 | 5.48 | 5.48 | ChEMBL |