CHEMBL3963154
| SMILES | O[C@H]1C[C@@]2(n3cnc4c(NCCF)nc(Cl)nc43)C[C@H]2[C@H]1O |
| InChIKey | DPUBULFFBDRKMI-FWAJVQJESA-N |
Chemical properties
| Hydrogen bond acceptors | 7 |
| Hydrogen bond donors | 3 |
| Rotatable bonds | 4 |
| Molecular weight (Da) | 327.1 |
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 |
| A3 | AA3R | Human | Adenosine | A | pKi | 7.49 | 7.49 | 7.49 | ChEMBL |
| A1 | AA1R | Human | Adenosine | A | pKi | 7.14 | 7.14 | 7.14 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |