CHEMBL251874
SMILES | CCCCn1c(=O)[nH]c2nc(-c3cnn(Cc4ccccc4)c3)[nH]c2c1=O |
InChIKey | KWOQGNHDXLJPBS-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 2 |
Rotatable bonds | 6 |
Molecular weight (Da) | 364.2 |
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 | 7.47 | 7.47 | 7.47 | ChEMBL |
A3 | AA3R | Human | Adenosine | A | pKi | 6.96 | 6.96 | 6.96 | ChEMBL |
A2A | AA2AR | Human | Adenosine | A | pKi | 5.47 | 5.47 | 5.47 | ChEMBL |
A1 | AA1R | Human | Adenosine | A | pKi | 5.29 | 5.29 | 5.29 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |