CHEMBL424869
SMILES | CCCc1nc2[nH]c(-c3ccccc3)nc(-c3ccccc3)c-2n1 |
InChIKey | LIJDFWULFIYULY-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 1 |
Rotatable bonds | 4 |
Molecular weight (Da) | 314.2 |
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 |
A3 | AA3R | Human | Adenosine | A | pKi | 7.77 | 7.77 | 7.77 | ChEMBL |
A2A | AA2AR | Human | Adenosine | A | pKi | 6.78 | 6.78 | 6.78 | ChEMBL |
A1 | AA1R | Human | Adenosine | A | pKi | 8.36 | 8.36 | 8.36 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |