CHEMBL524037
| SMILES | O=CNc1cc(C(O)CNCCCCCCNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)ccc1O |
| InChIKey | RYVVFUHRFAJPCC-NDIYSDBASA-N |
Chemical properties
| Hydrogen bond acceptors | 13 |
| Hydrogen bond donors | 8 |
| Rotatable bonds | 15 |
| Molecular weight (Da) | 545.3 |
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 |
| β2 | ADRB2 | Golden hamster | Adrenoceptors | A | pKi | 6.51 | 6.51 | 6.51 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| β2 | ADRB2 | Golden hamster | Adrenoceptors | A | pEC50 | 8.22 | 8.22 | 8.22 | ChEMBL |