CHEMBL5778353


SMILES CNC(=O)[C@]12CC1[C@@H](n1cnc3c(NC4CC4c4cccc(C)c4)nc(C#Cc4ccccc4)nc31)[C@H](O)C2O
InChIKey DUGPHRKMHFZAQT-DNZSJIDNSA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 4
Rotatable bonds 5
Molecular weight (Da) 534.2

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 Human Adenosine A pKi 7.75 7.75 7.75 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database