CHEMBL67949
SMILES | O=c1[nH]c2[nH]cnc2c(=O)n1CCc1ccccc1 |
InChIKey | WZIAGOQSFXTMAJ-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 2 |
Rotatable bonds | 3 |
Molecular weight (Da) | 256.1 |
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 |
A1 | AA1R | Rat | Adenosine | A | pKi | 4.42 | 4.67 | 4.92 | ChEMBL |
A3 | AA3R | Human | Adenosine | A | pKi | 5.12 | 5.12 | 5.12 | ChEMBL |
A2B | AA2BR | Human | Adenosine | A | pKi | 6.39 | 6.39 | 6.39 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |