CHEMBL342906


SMILES O=C(Nc1cccc(Cl)c1)Nc1nc2nn(CCCc3ccccc3)cc2c2nc(-c3ccco3)nn12
InChIKey NVIPLOWTLXCBSA-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 2
Rotatable bonds 7
Molecular weight (Da) 512.1

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
A2A AA2AR Rat Adenosine A pKi 5.5 5.5 5.5 ChEMBL
A2B AA2BR Human Adenosine A pKi 6.65 6.65 6.65 ChEMBL
A3 AA3R Human Adenosine A pKi 4.22 6.86 7.37 ChEMBL
A2A AA2AR Human Adenosine A pKi 6.7 6.7 6.7 ChEMBL
A1 AA1R Human Adenosine A pKi 5.82 5.82 5.82 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database