CHEMBL3969868
| SMILES | Nc1nc2cccc(Cl)c2c2nc(-c3ccco3)nn12 |
| InChIKey | LTHNIAHTIWLCEM-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 6 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 1 |
| Molecular weight (Da) | 285.0 |
Drug properties
| Molecular type | Small molecule |
| Endogenous/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 | 7.46 | 7.46 | 7.46 | ChEMBL |
| A2A | AA2AR | Human | Adenosine | A | pKi | 8.92 | 8.92 | 8.92 | ChEMBL |
| A1 | AA1R | Human | Adenosine | A | pKi | 8.46 | 8.46 | 8.46 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |