CHEMBL2113685


SMILES CSc1nc(NCc2cccc(I)c2)c2ncn(C[C@H](O)CO)c2n1
InChIKey AQADPXZMOSNTQN-LBPRGKRZSA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 3
Rotatable bonds 7
Molecular weight (Da) 471.0

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
A3 AA3R Rat Adenosine A pKi 5.07 5.07 5.07 ChEMBL
A2A AA2AR Rat Adenosine A pKi 4.1 4.1 4.1 ChEMBL
A1 AA1R Rat Adenosine A pKi 5.87 5.87 5.87 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database