CHEMBL550636


SMILES Nc1nc(C(=O)NCc2cccc(F)c2)cc(-c2ccco2)n1
InChIKey WPZSHLBDZYXRMN-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 4
Molecular weight (Da) 312.1

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
A2B AA2BR Human Adenosine A pKi 6.03 6.03 6.03 ChEMBL
A3 AA3R Human Adenosine A pKi 5.97 5.97 5.97 ChEMBL
A2A AA2AR Human Adenosine A pKi 8.32 8.32 8.32 ChEMBL
A1 AA1R Human Adenosine A pKi 7.41 7.41 7.41 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database