CHEMBL4470730


SMILES COC(=O)c1ncn([C@H]2[C@H](O)[C@H](O)[C@]3(CO)C[C@H]23)n1
InChIKey BTUSKDGBTDGYET-VGVCMWPDSA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 3
Rotatable bonds 3
Molecular weight (Da) 269.1

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
A1 AA1R Mouse Adenosine A pKi 5.52 5.52 5.52 ChEMBL
β3 ADRB3 Human Adrenoceptors A pKi 5.85 5.85 5.85 ChEMBL
H3 HRH3 Human Histamine A pKi 5.34 5.34 5.34 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database