CHEMBL123172
SMILES | CCCCc1nc2[nH]cnc2c2nc(-c3cccc(OC)c3)nn12 |
InChIKey | CVFTYEHUWFKCFO-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 1 |
Rotatable bonds | 5 |
Molecular weight (Da) | 322.2 |
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 |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
A3 | AA3R | Human | Adenosine | A | pIC50 | 9.66 | 9.66 | 9.66 | ChEMBL |
A2A | AA2AR | Human | Adenosine | A | pIC50 | 7.17 | 7.17 | 7.17 | ChEMBL |