CHEMBL5397120


SMILES CCc1ccccc1OC[C@@H](O)CNCCC(c1ccccc1)c1ccccc1
InChIKey MBVZCWDDTQDBJD-DEOSSOPVSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 11
Molecular weight (Da) 389.2

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
β3 ADRB3 Human Adrenoceptors A pKd 6.37 6.37 6.37 ChEMBL
β1 ADRB1 Human Adrenoceptors A pKd 6.87 6.87 6.87 ChEMBL
β2 ADRB2 Human Adrenoceptors A pKd 7.73 7.73 7.73 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
β3 ADRB3 Human Adrenoceptors A pEC50 5.52 5.52 5.52 ChEMBL
β1 ADRB1 Human Adrenoceptors A pEC50 6.51 6.51 6.51 ChEMBL
β2 ADRB2 Human Adrenoceptors A pEC50 6.86 6.86 6.86 ChEMBL