8-Bromoadenosine
SMILES | C1=NC2=C(C(=N1)N)N=C(N2C3C(C(C(O3)CO)O)O)Br |
InChIKey | VJUPMOPLUQHMLE-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 9 |
Hydrogen bond donors | 4 |
Rotatable bonds | 2 |
Molecular weight (Da) | 345.0 |
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 | 5.0 | 5.0 | 5.0 | PDSP Ki database |
A1 | AA1R | Rat | Adenosine | A | pKi | 7.38 | 7.38 | 7.38 | PDSP Ki database |
A3 | AA3R | Rat | Adenosine | A | pKi | 7.5 | 7.5 | 7.5 | PDSP Ki database |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |