CHEMBL2113573


SMILES O=C(NC1CC1)[C@H]1O[C@@H](n2cnc3c(NCCc4cn(CCN5CCCC5)c5ccccc45)ncnc32)[C@H](O)[C@@H]1O
InChIKey ZXOHLUVTWXSWHF-APSVEGKFSA-N

Chemical properties

Hydrogen bond acceptors 11
Hydrogen bond donors 4
Rotatable bonds 10
Molecular weight (Da) 560.3

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
A1 AA1R Rat Adenosine A pKi 8.12 8.12 8.12 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database