Ligand Data

Ligand

id 446
Name arformoterol
SMILES O=CNc1cc(ccc1O)[C@H](CN[C@@H](Cc1ccc(cc1)OC)C)O
InChIKey BPZSYCZIITTYBL-YJYMSZOUSA-N
Type small-molecule
External Links
Structure pdb 6IBL 6TKO 7BZ2

Structure

Properties

Hydrogen bond acceptors 5
Hydrogen bond donors 4
Rotatable bonds 9
Molecular weight 344.2


Bioactivity

Receptor Affinity (nM) Potency (nM)
GTP Uniprot Species Family Class Min Avg Max Min Avg Max
β2 ADRB2 Guinea pig Adrenoceptors A (Rhodopsin) 0.1 0.2 0.3
β1 ADRB1 Human Adrenoceptors A (Rhodopsin) 39.8 39.8 39.8
β3 ADRB3 Human Adrenoceptors A (Rhodopsin) 25.1 25.1 25.1
β2 ADRB2 Human Adrenoceptors A (Rhodopsin) 0.3 0.5 0.5