CHEMBL4463925


SMILES COc1cc(CCNC[C@@H](O)COc2cccc3ccccc23)ccc1OCCCSSCCN
InChIKey QJSQCJQXYAAGGS-HSZRJFAPSA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 3
Rotatable bonds 17
Molecular weight (Da) 516.2

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 Mouse Adrenoceptors A pKi 7.48 7.48 7.48 ChEMBL
β2 ADRB2 Human Adrenoceptors A pKi 8.96 8.96 8.96 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database