CHEMBL2113415


SMILES O=C(Nc1nc(Cl)nc2c1ncn2[C@@H]1OC[C@@H](O)[C@H]1O)c1cccc(I)c1
InChIKey OPKBULKSQYNGHO-XDMRBOTDSA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 3
Rotatable bonds 3
Molecular weight (Da) 501.0

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 6.56 6.56 6.56 ChEMBL
A2A AA2AR Rat Adenosine A pKi 5.54 5.54 5.54 ChEMBL
A1 AA1R Rat Adenosine A pKi 6.09 6.09 6.09 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database