ARFORMOTEROL


SMILES COc1ccc(C[C@@H](C)NC[C@H](O)c2ccc(O)c(NC=O)c2)cc1
InChIKey BPZSYCZIITTYBL-YJYMSZOUSA-N

Chemical properties

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

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Structure pdb 7BZ2 6TKO 6IBL 8JJ8

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
β1 ADRB1 Human Adrenoceptors A pKi 5.77 6.99 8.21 PDSP Ki database
β2 ADRB2 Human Adrenoceptors A pKi 5.59 7.11 8.11 PDSP Ki database
β3 ADRB3 Human Adrenoceptors A pKi 5.09 6.67 8.26 PDSP Ki database
β1 ADRB1 Human Adrenoceptors A pKi 8.19 8.19 8.19 Drug Central
β1 ADRB1 Human Adrenoceptors A pKd 8.16 8.16 8.16 Drug Central
β2 ADRB2 Human Adrenoceptors A pKd 8.07 8.07 8.07 Drug Central
D2 DRD2 Human Dopamine A pKi 8.31 8.31 8.31 Drug Central
D3 DRD3 Human Dopamine A pKi 8.24 8.24 8.24 Drug Central
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
β2 ADRB2 Guinea pig Adrenoceptors A pEC50 9.5 9.8 9.9 ChEMBL
β3 ADRB3 Human Adrenoceptors A pEC50 7.6 7.6 7.6 ChEMBL
β1 ADRB1 Human Adrenoceptors A pEC50 6.96 7.29 7.4 ChEMBL
β2 ADRB2 Human Adrenoceptors A pEC50 8.58 9.2 9.5 ChEMBL
β3 ADRB3 Human Adrenoceptors A pEC50 8.12 8.12 8.12 Drug Central
β2 ADRB2 Guinea pig Adrenoceptors A pEC50 8.0 8.03 8.06 Drug Central