CHEMBL322250
SMILES | CCCn1c(=O)c2c(nc3ccccn32)n(Cc2ccccc2)c1=O |
InChIKey | LDLBAAURBBVHGB-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 0 |
Rotatable bonds | 4 |
Molecular weight (Da) | 334.1 |
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 |
A3 | AA3R | Human | Adenosine | A | pKi | 8.4 | 8.4 | 8.4 | ChEMBL |
A2A | AA2AR | Human | Adenosine | A | pKi | 6.92 | 6.92 | 6.92 | ChEMBL |
A1 | AA1R | Human | Adenosine | A | pKi | 7.3 | 7.3 | 7.3 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |