CHEMBL3314876
SMILES | CCOC(=O)c1cnc(N)n2nc(-c3ccco3)nc12 |
InChIKey | PUVYFFNVIIAMAD-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 8 |
Hydrogen bond donors | 1 |
Rotatable bonds | 3 |
Molecular weight (Da) | 273.1 |
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 |
A2B | AA2BR | Human | Adenosine | A | pKi | 5.96 | 5.96 | 5.96 | ChEMBL |
A3 | AA3R | Human | Adenosine | A | pKi | 6.62 | 6.62 | 6.62 | ChEMBL |
A2A | AA2AR | Human | Adenosine | A | pKi | 8.48 | 8.48 | 8.48 | ChEMBL |
A1 | AA1R | Human | Adenosine | A | pKi | 6.73 | 6.73 | 6.73 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |