CHEMBL2380385
SMILES | O=C(CCc1ccccc1)Nc1nc2ccccc2c(=O)s1 |
InChIKey | KLNYLDYPZCWDDA-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 4 |
Molecular weight (Da) | 310.1 |
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 | 6.99 | 6.99 | 6.99 | ChEMBL |
A1 | AA1R | Rat | Adenosine | A | pKi | 6.38 | 6.38 | 6.38 | ChEMBL |
A2B | AA2BR | Human | Adenosine | A | pKi | 6.44 | 6.44 | 6.44 | ChEMBL |
A3 | AA3R | Human | Adenosine | A | pKi | 6.41 | 6.41 | 6.41 | ChEMBL |
A2A | AA2AR | Human | Adenosine | A | pKi | 7.09 | 7.09 | 7.09 | ChEMBL |
A1 | AA1R | Human | Adenosine | A | pKi | 5.98 | 5.98 | 5.98 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |