CHEMBL167985
| SMILES | O=C(Nc1nc(-c2ccccc2)ns1)C1CCC(O)CC1 |
| InChIKey | HIYKPJVEMCGNEK-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 3 |
| Molecular weight (Da) | 303.1 |
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 | Rat | Adenosine | A | pKi | 7.38 | 7.54 | 7.7 | ChEMBL |
| A3 | AA3R | Human | Adenosine | A | pKi | 5.57 | 5.64 | 5.72 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |