CHEMBL2070398


SMILES Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)NCC(F)(F)F)[C@@H](O)[C@H]1O
InChIKey YZDMWFGIVFREQG-QMWPFBOUSA-N

Chemical properties

Hydrogen bond acceptors 9
Hydrogen bond donors 4
Rotatable bonds 3
Molecular weight (Da) 362.1

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
A2A AA2AR Rat Adenosine A pKi 6.39 6.39 6.39 ChEMBL
A3 AA3R Human Adenosine A pKi 6.15 6.16 6.16 ChEMBL
A2A AA2AR Human Adenosine A pKi 6.75 6.75 6.75 ChEMBL
A1 AA1R Human Adenosine A pKi 7.82 7.82 7.82 ChEMBL
A1 AA1R Rat Adenosine A pKi 5.92 5.92 5.92 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database