CHEMBL1078001
SMILES | Cc1ccc(C(=O)c2nc(NC(=O)c3cccnc3)nc3ccsc23)s1 |
InChIKey | RMNYIORRJFTYKB-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 7 |
Hydrogen bond donors | 1 |
Rotatable bonds | 4 |
Molecular weight (Da) | 380.0 |
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 | 6.54 | 6.54 | 6.54 | ChEMBL |
A2A | AA2AR | Human | Adenosine | A | pIC50 | 6.79 | 6.79 | 6.79 | ChEMBL |