CHEMBL3314897
SMILES | CCOC(=O)c1cnc(NCc2ccc(OC)cc2)n2nc(-c3ccco3)nc12 |
InChIKey | PLXYZBPDEWWLHQ-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 9 |
Hydrogen bond donors | 1 |
Rotatable bonds | 7 |
Molecular weight (Da) | 393.1 |
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 |
A2B | AA2BR | Human | Adenosine | A | pKi | 5.32 | 5.32 | 5.32 | ChEMBL |
A3 | AA3R | Human | Adenosine | A | pKi | 7.24 | 7.24 | 7.24 | ChEMBL |
A2A | AA2AR | Human | Adenosine | A | pKi | 6.85 | 6.85 | 6.85 | ChEMBL |
A1 | AA1R | Human | Adenosine | A | pKi | 5.9 | 5.9 | 5.9 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |