CHEMBL2113096


SMILES Cc1nccn1-c1sc(Nc2cnccn2)nc1-c1cccc(C#N)c1
InChIKey YNGFNKUXMJZNCR-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight (Da) 359.1

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
A3 AA3R Human Adenosine A pKi 8.0 8.0 8.0 ChEMBL
A2A AA2AR Human Adenosine A pKi 5.78 5.78 5.78 ChEMBL
A1 AA1R Human Adenosine A pKi 6.71 6.71 6.71 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database