CHEMBL2112175


SMILES CNC(=O)[C@]12C[C@@H]1[C@@H](n1cnc3c(NC)nc(N)nc31)[C@H](O)[C@@H]2O
InChIKey WLUDRMVXTPQXJU-FUOPTRAXSA-N

Chemical properties

Hydrogen bond acceptors 9
Hydrogen bond donors 5
Rotatable bonds 3
Molecular weight (Da) 333.2

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 8.8 8.8 8.8 ChEMBL
A1 AA1R Human Adenosine A pKi 5.8 5.8 5.8 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database