CHEMBL73809
SMILES | C[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(N)ncnc21 |
InChIKey | PASOFFRBGIVJET-YRKGHMEHSA-N |
Chemical properties
Hydrogen bond acceptors | 9 |
Hydrogen bond donors | 4 |
Rotatable bonds | 2 |
Molecular weight (Da) | 281.1 |
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 | Bovine | Adenosine | A | pKi | 5.95 | 6.04 | 6.13 | ChEMBL |
A2A | AA2AR | Rat | Adenosine | A | pKi | 5.47 | 5.47 | 5.47 | ChEMBL |
A1 | AA1R | Rat | Adenosine | A | pKi | 6.13 | 6.13 | 6.13 | ChEMBL |
A2A | AA2AR | Human | Adenosine | A | pKi | 5.24 | 5.36 | 5.47 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |