CHEMBL3114164
SMILES | CC(C)n1cc2c(Cl)nc(NC(=O)Cc3ccccc3)nc2n1 |
InChIKey | SAPBOGWWNLGWQD-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 4 |
Molecular weight (Da) | 329.1 |
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 |
A2A | AA2AR | Human | Adenosine | A | pKi | 5.33 | 5.33 | 5.33 | ChEMBL |
A1 | AA1R | Human | Adenosine | A | pKi | 5.72 | 5.72 | 5.72 | ChEMBL |
A3 | AA3R | Human | Adenosine | A | pKi | 4.57 | 4.57 | 4.57 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |