CHEMBL448802


SMILES c1ccc([C@@H]2Cc3nccn3C2)c(-c2ncco2)c1
InChIKey MIWWMVGPFZMLEG-LLVKDONJSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 0
Rotatable bonds 2
Molecular weight (Da) 251.1

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
α2A ADA2A Human Adrenoceptors A pKi 6.09 6.09 6.09 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
α1A ADA1A Human Adrenoceptors A pEC50 8.7 8.7 8.7 ChEMBL
α1D ADA1D Human Adrenoceptors A pEC50 6.84 6.84 6.84 ChEMBL