CHEMBL239016
SMILES | CC(=O)OC(c1ccccc1)C(C)N1CCCn2c1nc1c2c(=O)n(C)c(=O)n1C |
InChIKey | IUKJNANPCOOWII-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 9 |
Hydrogen bond donors | 0 |
Rotatable bonds | 4 |
Molecular weight (Da) | 411.2 |
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 |
A2A | AA2AR | Rat | Adenosine | A | pKi | 5.91 | 5.91 | 5.91 | ChEMBL |
A1 | AA1R | Rat | Adenosine | A | pKi | 5.47 | 5.47 | 5.47 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |