CHEMBL553449


SMILES Cc1cccc(CNC(=O)c2cc(-c3ccco3)nc(N)n2)c1
InChIKey XCILVOURWDGPPK-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 4
Molecular weight (Da) 308.1

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
A2B AA2BR Human Adenosine A pKi 6.4 6.4 6.4 ChEMBL
A3 AA3R Human Adenosine A pKi 5.82 5.82 5.82 ChEMBL
A2A AA2AR Human Adenosine A pKi 8.59 8.59 8.59 ChEMBL
A1 AA1R Human Adenosine A pKi 7.42 7.42 7.42 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database