CHEMBL3410301
| SMILES | CCOC(=O)c1nc(N)nc2nn(CCc3ccccc3)cc12 |
| InChIKey | RQLOGUYSNDTKSC-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 7 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 5 |
| Molecular weight (Da) | 311.1 |
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 |
| A2B | AA2BR | Human | Adenosine | A | pKi | 4.22 | 4.22 | 4.22 | ChEMBL |
| A3 | AA3R | Human | Adenosine | A | pKi | 4.74 | 4.74 | 4.74 | ChEMBL |
| A2A | AA2AR | Human | Adenosine | A | pKi | 5.32 | 5.32 | 5.32 | ChEMBL |
| A1 | AA1R | Human | Adenosine | A | pKi | 5.46 | 5.46 | 5.46 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |