CHEMBL4097464
SMILES | Cc1cn2c(=O)n(-c3ccc(O)cc3)nc2c(N)n1 |
InChIKey | AJSWBABABMMWJK-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 7 |
Hydrogen bond donors | 2 |
Rotatable bonds | 1 |
Molecular weight (Da) | 257.1 |
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 |
A3 | AA3R | Human | Adenosine | A | pKi | 5.29 | 5.29 | 5.29 | ChEMBL |
A2A | AA2AR | Human | Adenosine | A | pKi | 5.88 | 5.88 | 5.88 | ChEMBL |
A1 | AA1R | Human | Adenosine | A | pKi | 6.0 | 6.0 | 6.0 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |