CHEMBL5867976
| SMILES | Cn1cc(-c2nc(C(=O)NCc3c(F)cccc3F)c(N)nc2-c2ncco2)ccc1=O |
| InChIKey | UPJFBUSSMBUXBJ-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 8 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 5 |
| Molecular weight (Da) | 438.1 |
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 |
| A2B | AA2BR | Human | Adenosine | A | pIC50 | 8.85 | 8.85 | 8.85 | ChEMBL |
| A1 | AA1R | Human | Adenosine | A | pIC50 | 7.8 | 7.8 | 7.8 | ChEMBL |
| A2A | AA2AR | Human | Adenosine | A | pIC50 | 8.72 | 8.72 | 8.72 | ChEMBL |