CHEMBL210380
SMILES | Cc1ccc(Nc2[nH]c3ccccc3c3nc(C4CCCC4)nc2-3)cc1 |
InChIKey | WXNNVWNRFVWROJ-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 2 |
Rotatable bonds | 3 |
Molecular weight (Da) | 342.2 |
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 |
A3 | AA3R | Human | Adenosine | A | pKi | 5.92 | 5.92 | 5.92 | ChEMBL |
A2A | AA2AR | Human | Adenosine | A | pKi | 5.28 | 5.28 | 5.28 | ChEMBL |
A1 | AA1R | Human | Adenosine | A | pKi | 5.42 | 5.42 | 5.42 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |