CHEMBL5762874
| SMILES | COc1cc2nc(N)n3nc(C4CCC(C)N(c5cnn(CC(C)(C)N)c5)C4)nc3c2cc1F |
| InChIKey | YQRKOALQSIXBDL-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 10 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 5 |
| Molecular weight (Da) | 467.3 |
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 |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| A2A | AA2AR | Human | Adenosine | A | pIC50 | 7.58 | 8.12 | 8.66 | ChEMBL |
| A2B | AA2BR | Human | Adenosine | A | pIC50 | 6.29 | 6.96 | 7.62 | ChEMBL |