CHEMBL4301544


SMILES COc1ccc(CCNCC(O)COc2cccc3c(=O)c4ccccc4oc23)cc1OC
InChIKey JSDPSJVNZKTYNN-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 2
Rotatable bonds 10
Molecular weight (Da) 449.2

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 Rat Adrenoceptors A pKi 6.45 6.45 6.45 ChEMBL
β2 ADRB2 Guinea pig Adrenoceptors A pKd 7.38 7.38 7.38 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
β1 ADRB1 Rat Adrenoceptors A pIC50 6.97 6.97 6.97 ChEMBL