CHEMBL1800934


SMILES COc1ccc(C[C@H](C)NC[C@H](O)c2cc(O)cc(O)c2)c2ccccc12
InChIKey MLQLUFQBFMFXJO-QKKBWIMNSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 4
Rotatable bonds 7
Molecular weight (Da) 367.2

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 4.83 4.83 4.83 ChEMBL
β2 ADRB2 Human Adrenoceptors A pKi 6.5 7.43 7.9 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
β2 ADRB2 Human Adrenoceptors A pEC50 8.4 8.4 8.4 ChEMBL
β2 ADRB2 Human Adrenoceptors A pIC50 8.36 8.36 8.36 ChEMBL