CHEMBL5921476
| SMILES | Cn1cc(-c2c(-n3cccn3)nc(N)n3nc(Cc4ncccc4F)nc23)ccc1=O |
| InChIKey | WWGWJTQBATTYLS-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 10 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 4 |
| Molecular weight (Da) | 417.1 |
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 |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| A2A | AA2AR | Mouse | Adenosine | A | pIC50 | 6.9 | 6.9 | 6.9 | ChEMBL |
| A2B | AA2BR | Human | Adenosine | A | pIC50 | 5.81 | 5.81 | 5.81 | ChEMBL |
| A1 | AA1R | Human | Adenosine | A | pIC50 | 6.6 | 6.6 | 6.6 | ChEMBL |
| A2A | AA2AR | Human | Adenosine | A | pIC50 | 6.91 | 6.91 | 6.91 | ChEMBL |