CHEMBL354004
SMILES | O=C(O)COc1ccc(C(=O)Nc2nc(-c3ccccc3)ns2)cc1 |
InChIKey | JZAHMVTXFHMSNE-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 2 |
Rotatable bonds | 6 |
Molecular weight (Da) | 355.1 |
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 |
A2A | AA2AR | Rat | Adenosine | A | pKi | 4.82 | 4.82 | 4.82 | ChEMBL |
A1 | AA1R | Rat | Adenosine | A | pKi | 7.0 | 7.0 | 7.0 | ChEMBL |
A3 | AA3R | Human | Adenosine | A | pKi | 5.92 | 5.92 | 5.92 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |