CHEMBL400049


SMILES CCc1nc(-c2ccc(OCCNC[C@H](O)c3cccnc3)cc2)co1
InChIKey HGWFPEHKILIAAE-IBGZPJMESA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 9
Molecular weight (Da) 353.2

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
β1 ADRB1 Human Adrenoceptors A pKi 6.4 6.4 6.4 ChEMBL
β2 ADRB2 Human Adrenoceptors A pKi 7.43 7.43 7.43 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
β3 ADRB3 Human Adrenoceptors A pEC50 7.24 7.24 7.24 ChEMBL