CHEMBL5402516
| SMILES | O[C@@H](CNCC1COc2ccccc2O1)COc1ccnc2ccccc12 |
| InChIKey | VKCGFPFUOZQWSP-VYRBHSGPSA-N |
Chemical properties
| Hydrogen bond acceptors | 6 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 7 |
| Molecular weight (Da) | 366.2 |
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 |
| β3 | ADRB3 | Human | Adrenoceptors | A | pKd | 5.11 | 5.11 | 5.11 | ChEMBL |
| β1 | ADRB1 | Human | Adrenoceptors | A | pKd | 5.22 | 5.22 | 5.22 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |