CHEMBL3298831


SMILES O=c1ccc2c([C@@H](O)CNCCc3ccc(Nc4ccc(OCCN5CCOCC5)cc4)cc3)ccc(O)c2[nH]1
InChIKey GPANSMBREMKPKY-LJAQVGFWSA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 5
Rotatable bonds 12
Molecular weight (Da) 544.3

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
β2 ADRB2 Human Adrenoceptors A pKi 7.7 7.7 7.7 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
β1 ADRB1 Human Adrenoceptors A pEC50 7.9 7.9 7.9 ChEMBL
β3 ADRB3 Human Adrenoceptors A pEC50 7.3 7.3 7.3 ChEMBL
β2 ADRB2 Human Adrenoceptors A pEC50 8.5 9.0 9.5 ChEMBL