CHEMBL5850961
| SMILES | COc1cc2nc(N)n3nc([C@@H]4CCCN(c5cnn(CC6(C)COC6)c5)C4)nc3c2cc1F |
| InChIKey | MOUJGKYCWVVASR-CQSZACIVSA-N |
Chemical properties
| Hydrogen bond acceptors | 10 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 5 |
| Molecular weight (Da) | 466.2 |
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 | 7.42 | 7.42 | 7.42 | ChEMBL |
| A2B | AA2BR | Human | Adenosine | A | pIC50 | 6.04 | 6.04 | 6.04 | ChEMBL |