CHEMBL1935752


SMILES Cn1ncc2nc(N)n3nc(-c4ccco4)nc3c21
InChIKey JGOMPASXQKCRSZ-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 1
Rotatable bonds 1
Molecular weight (Da) 255.1

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
A1 AA1R Human Adenosine A pKi 8.0 8.0 8.0 ChEMBL
A2A AA2AR Human Adenosine A pKi 8.44 8.44 8.44 ChEMBL
A3 AA3R Human Adenosine A pKi 6.13 6.13 6.13 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
A2B AA2BR Human Adenosine A pIC50 7.51 7.51 7.51 ChEMBL