CHEMBL218407


SMILES CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NC)nc(N=[N+]=[N-])nc32)[C@H](O)[C@@H]1O
InChIKey VCOMAHDWTHMIAK-FLNNQWSLSA-N

Chemical properties

Hydrogen bond acceptors 10
Hydrogen bond donors 4
Rotatable bonds 5
Molecular weight (Da) 363.1

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
A3 AA3R Human Adenosine A pKi 7.94 7.94 7.94 ChEMBL
A1 AA1R Human Adenosine A pKi 6.37 6.37 6.37 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database