CHEMBL1080068
SMILES | O=C(c1cccs1)c1nc(NCc2cccnc2)nc2cc(Cl)sc12 |
InChIKey | HWFLOIWTEDBAFA-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 7 |
Hydrogen bond donors | 1 |
Rotatable bonds | 5 |
Molecular weight (Da) | 386.0 |
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 |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
A2B | AA2BR | Human | Adenosine | A | pIC50 | 7.8 | 7.8 | 7.8 | ChEMBL |
A2A | AA2AR | Human | Adenosine | A | pIC50 | 7.21 | 7.21 | 7.21 | ChEMBL |