CHEMBL3088336
| SMILES | COc1ccc(Nc2nc3c(Cl)ncnc3s2)cc1 |
| InChIKey | KGFDYSUSOUEZEF-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 6 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 3 |
| Molecular weight (Da) | 292.0 |
Drug properties
| Molecular type | Small molecule |
| Endogenous/Surrogate | Surrogate |
| Approved drug | No |
Database connections
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| A1 | AA1R | Human | Adenosine | A | pKi | 4.94 | 4.94 | 4.94 | ChEMBL |
| A2A | AA2AR | Human | Adenosine | A | pKi | 5.45 | 5.45 | 5.45 | ChEMBL |
| A3 | AA3R | Human | Adenosine | A | pKi | 5.23 | 5.23 | 5.23 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |