BOPINDOLOL


SMILES Cc1cc2c(OCC(CNC(C)(C)C)OC(=O)c3ccccc3)cccc2[nH]1
InChIKey UUOJIACWOAYWEZ-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 7
Molecular weight (Da) 380.2

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 pKi 6.46 6.46 6.46 ChEMBL
β1 ADRB1 Human Adrenoceptors A pKi 7.57 7.57 7.57 ChEMBL
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pKi 6.82 6.82 6.82 ChEMBL
5-HT2B 5HT2B Human 5-Hydroxytryptamine A pKi 6.01 6.01 6.01 ChEMBL
β2 ADRB2 Human Adrenoceptors A pKi 7.85 7.85 7.85 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 6.34 6.34 6.34 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 8.17 8.17 8.17 Drug Central
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 8.2 8.2 8.2 Drug Central
5-HT2B 5HT2B Human 5-Hydroxytryptamine A pKi 8.22 8.22 8.22 Drug Central
β1 ADRB1 Human Adrenoceptors A pKi 8.02 8.02 8.02 Drug Central
β2 ADRB2 Human Adrenoceptors A pKi 8.02 8.02 8.02 Drug Central
β3 ADRB3 Human Adrenoceptors A pKi 8.19 8.19 8.19 Drug Central
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
β3 ADRB3 Human Adrenoceptors A pIC50 6.34 6.34 6.34 ChEMBL
β1 ADRB1 Human Adrenoceptors A pIC50 7.33 7.33 7.33 ChEMBL
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pIC50 6.57 6.57 6.57 ChEMBL
5-HT2B 5HT2B Human 5-Hydroxytryptamine A pIC50 5.82 5.82 5.82 ChEMBL
β2 ADRB2 Human Adrenoceptors A pIC50 7.7 7.7 7.7 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pIC50 5.8 5.8 5.8 ChEMBL
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pIC50 8.18 8.18 8.18 Drug Central