CHEMBL505633
SMILES | Nc1ncnc2c1nc(Br)n2CC(O)CO |
InChIKey | XXTHNUCUAMMCPB-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 7 |
Hydrogen bond donors | 3 |
Rotatable bonds | 3 |
Molecular weight (Da) | 287.0 |
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 | 5.15 | 5.15 | 5.15 | ChEMBL |
A2A | AA2AR | Human | Adenosine | A | pKi | 5.4 | 5.4 | 5.4 | ChEMBL |
A1 | AA1R | Human | Adenosine | A | pKi | 4.8 | 4.8 | 4.8 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |