CHEMBL595431
SMILES | CCn1c(=O)c2[nH]c(Cc3cccs3)nc2n(Cc2ccco2)c1=O |
InChIKey | PPBHCKHMCRVBPO-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 7 |
Hydrogen bond donors | 1 |
Rotatable bonds | 5 |
Molecular weight (Da) | 356.1 |
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 |
A2B | AA2BR | Human | Adenosine | A | pKi | 6.92 | 6.92 | 6.92 | ChEMBL |
A2A | AA2AR | Human | Adenosine | A | pKi | 6.44 | 6.44 | 6.44 | ChEMBL |
A1 | AA1R | Rat | Adenosine | A | pKi | 6.33 | 6.33 | 6.33 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |