CHEMBL4574652


SMILES CC(C)NC[C@H](O)COc1ccccc1CCNC(=O)NCCc1ccccc1OC[C@@H](O)CNC(C)C
InChIKey JMPQBBZKTCKZGR-UIOOFZCWSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 6
Rotatable bonds 18
Molecular weight (Da) 530.3

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
β1 ADRB1 Human Adrenoceptors A pKi 7.71 7.71 7.71 ChEMBL
β2 ADRB2 Human Adrenoceptors A pKi 8.46 8.46 8.46 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
β1 ADRB1 Human Adrenoceptors A pIC50 6.9 6.9 6.9 ChEMBL
β2 ADRB2 Human Adrenoceptors A pIC50 7.79 8.22 8.66 ChEMBL