indacaterol


SMILES CCc1cc2CC(Cc2cc1CC)NC[C@@H](c1ccc(c2c1ccc(=O)[nH]2)O)O
InChIKey QZZUEBNBZAPZLX-QFIPXVFZSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 4
Rotatable bonds 6
Molecular weight (Da) 392.2

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug Yes

Database connections

Sankey plot

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
β1 ADRB1 Human Adrenoceptors A pKi 6.7 6.7 6.7 Guide to Pharmacology
β1 ADRB1 Human Adrenoceptors A pKi 7.04 7.04 7.04 ChEMBL
β2 ADRB2 Human Adrenoceptors A pKi 7.12 7.5 7.69 ChEMBL
D3 DRD3 Human Dopamine A pKi 5.98 5.98 5.98 ChEMBL
β1 ADRB1 Human Adrenoceptors A pKi 8.15 8.15 8.15 Drug Central
D3 DRD3 Human Dopamine A pKi 8.22 8.22 8.22 Drug Central
β2 ADRB2 Human Adrenoceptors A pKi 8.11 8.11 8.11 Drug Central
β2 ADRB2 Human Adrenoceptors A pKi 7.4 7.6 7.8 Guide to Pharmacology
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
β2 ADRB2 Guinea pig Adrenoceptors A pIC50 8.1 8.1 8.1 ChEMBL
β1 ADRB1 Human Adrenoceptors A pIC50 6.5 6.5 6.5 ChEMBL
β2 ADRB2 Human Adrenoceptors A pEC50 7.8 8.42 9.1 ChEMBL
D2 DRD2 Human Dopamine A pIC50 8.34 8.34 8.34 Drug Central
β2 ADRB2 Guinea pig Adrenoceptors A pIC50 8.09 8.09 8.09 Drug Central
β2 ADRB2 Human Adrenoceptors A pEC50 8.1 8.1 8.1 Guide to Pharmacology