DEXPROPRANOLOL


SMILES CC(C)NC[C@@H](O)COc1cccc2ccccc12
InChIKey AQHHHDLHHXJYJD-CQSZACIVSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 6
Molecular weight (Da) 259.2

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Ligand site mutations β1 β2

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
β1 ADRB1 Human Adrenoceptors A pKi 6.67 6.67 6.67 ChEMBL
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pKi 5.55 5.66 5.77 ChEMBL
5-HT2B 5HT2B Human 5-Hydroxytryptamine A pKi 6.55 6.55 6.55 ChEMBL
β2 ADRB2 Human Adrenoceptors A pKi 7.28 7.28 7.28 ChEMBL
5-HT1B 5HT1B Rat 5-Hydroxytryptamine A pKi 5.15 5.15 5.15 PDSP Ki database
β1 ADRB1 Rat Adrenoceptors A pKi 7.09 7.09 7.09 PDSP Ki database
β2 ADRB2 Rat Adrenoceptors A pKi 7.36 7.36 7.36 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
5-HT1B 5HT1B Rat 5-Hydroxytryptamine A pIC50 6.31 6.31 6.31 ChEMBL
M1 ACM1 Rat Acetylcholine (muscarinic) A Potency 6.35 6.45 6.55 ChEMBL
β1 ADRB1 Human Adrenoceptors A pIC50 6.43 6.43 6.43 ChEMBL
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pIC50 5.31 6.04 6.77 ChEMBL
5-HT2B 5HT2B Human 5-Hydroxytryptamine A pIC50 6.36 6.36 6.36 ChEMBL
β2 ADRB2 Human Adrenoceptors A pIC50 7.12 7.12 7.12 ChEMBL
TSH TSHR Human Glycoprotein hormone A Potency 5.3 5.3 5.3 ChEMBL