CHEMBL5929739


SMILES CNC(=O)[C@]12CC1[C@@H](n1cnc3c(N/C=C(\O)c4ccccc4)nc(C#Cc4ccccc4)nc31)[C@H](O)C2O
InChIKey RVQQHXLRHWWCRY-IYIKALSTSA-N

Chemical properties

Hydrogen bond acceptors 9
Hydrogen bond donors 5
Rotatable bonds 5
Molecular weight (Da) 522.2

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
A3 AA3R Mouse Adenosine A pKi 6.87 6.87 6.87 ChEMBL
A3 AA3R Human Adenosine A pKi 7.11 7.11 7.11 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database