CHEMBL1258599


SMILES OC(CNC1CCN(c2ncnc3ccsc23)CC1)COc1ccccc1
InChIKey LKDUKYSSAMAXEU-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 2
Rotatable bonds 7
Molecular weight (Da) 384.2

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
β3 ADRB3 Human Adrenoceptors A pKi 7.39 7.39 7.39 ChEMBL
β1 ADRB1 Human Adrenoceptors A pKi 7.52 7.52 7.52 ChEMBL
β2 ADRB2 Human Adrenoceptors A pKi 7.85 7.85 7.85 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
β3 ADRB3 Human Adrenoceptors A pEC50 8.55 8.55 8.55 ChEMBL