CHEMBL2112077


SMILES C[C@@H](CO)n1cnc2c(NCc3cccc(I)c3)ncnc21
InChIKey NQKPQDMRLWLHNR-JTQLQIEISA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 5
Molecular weight (Da) 409.0

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 4.38 4.38 4.38 ChEMBL
A1 AA1R Rat Adenosine A pKi 4.72 4.72 4.72 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database