CHEMBL5086406


SMILES COc1cccc(-c2nc(N)nc(-c3ccccc3)c2C#N)c1
InChIKey XSVZFWPNIDCBRR-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 3
Molecular weight (Da) 302.1

Drug properties

Molecular type Unknown
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 7.51 7.51 7.51 ChEMBL
A1 AA1R Human Adenosine A pKi 8.68 8.68 8.68 ChEMBL
A2A AA2AR Human Adenosine A pKi 8.16 8.16 8.16 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database