CHEMBL4450606


SMILES CC(C)NC[C@H](O)COc1ccccc1CCC(=O)NCCNC(=O)CCc1ccccc1OC[C@@H](O)CNC(C)C
InChIKey DLWQCNIEYRGGDL-NSOVKSMOSA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 6
Rotatable bonds 21
Molecular weight (Da) 586.4

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 6.57 6.57 6.57 ChEMBL
β2 ADRB2 Human Adrenoceptors A pKi 7.93 7.93 7.93 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
β1 ADRB1 Human Adrenoceptors A pIC50 5.69 5.69 5.69 ChEMBL
β2 ADRB2 Human Adrenoceptors A pIC50 7.12 7.8 8.48 ChEMBL