CHEMBL1076563
| SMILES | O=c1[nH]c2cc(-c3ccncn3)c(-c3ccco3)nc2[nH]1 |
| InChIKey | MKVQVZUHJKLKRR-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 2 |
| Molecular weight (Da) | 279.1 |
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 |
| A2A | AA2AR | Human | Adenosine | A | pKi | 6.11 | 6.11 | 6.11 | ChEMBL |
| A1 | AA1R | Human | Adenosine | A | pKi | 6.5 | 6.5 | 6.5 | ChEMBL |
| A2B | AA2BR | Human | Adenosine | A | pKi | 8.22 | 8.22 | 8.22 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |