CHEMBL21053
SMILES | Cn1c(=O)c2c(nc(-c3ccccc3)n2C)n(C)c1=O |
InChIKey | MBYIBRUTNFFDFL-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 0 |
Rotatable bonds | 1 |
Molecular weight (Da) | 270.1 |
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 |
A2A | AA2AR | Guinea pig | Adenosine | A | pKi | 4.57 | 4.57 | 4.57 | ChEMBL |
A2A | AA2AR | Rat | Adenosine | A | pKi | 4.57 | 4.66 | 4.8 | ChEMBL |
A1 | AA1R | Rat | Adenosine | A | pKi | 4.48 | 4.77 | 4.82 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |