CHEMBL3088336
SMILES | COc1ccc(Nc2nc3c(Cl)ncnc3s2)cc1 |
InChIKey | KGFDYSUSOUEZEF-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 1 |
Rotatable bonds | 3 |
Molecular weight (Da) | 292.0 |
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 |
A2A | AA2AR | Human | Adenosine | A | pKi | 5.45 | 5.45 | 5.45 | ChEMBL |
A1 | AA1R | Human | Adenosine | A | pKi | 4.94 | 4.94 | 4.94 | ChEMBL |
A3 | AA3R | Human | Adenosine | A | pKi | 5.23 | 5.23 | 5.23 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |