CHEMBL2180916
SMILES | CONc1nc2nn(C)cc2c2nc(-c3ccco3)nn12 |
InChIKey | CQWRQINOVNKCQT-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 9 |
Hydrogen bond donors | 1 |
Rotatable bonds | 3 |
Molecular weight (Da) | 285.1 |
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 |
A3 | AA3R | Human | Adenosine | A | pKi | 6.39 | 6.39 | 6.39 | ChEMBL |
A2A | AA2AR | Human | Adenosine | A | pKi | 6.73 | 6.73 | 6.73 | ChEMBL |
A1 | AA1R | Human | Adenosine | A | pKi | 5.56 | 5.56 | 5.56 | ChEMBL |
A2B | AA2BR | Human | Adenosine | A | pKi | 5.07 | 5.07 | 5.07 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |