PROPRANOLOL


SMILES CC(C)NCC(COC1=CC=CC2=CC=CC=C21)O
InChIKey AQHHHDLHHXJYJD-UHFFFAOYSA-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

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
5-HT2C 5HT2C Rat 5-Hydroxytryptamine A pKi 5.61 5.9 6.24 PDSP Ki database
5-HT2C 5HT2C Mouse 5-Hydroxytryptamine A pKi 6.24 6.24 6.24 PDSP Ki database
5-HT2C K7GSR7 Pig 5-Hydroxytryptamine A pKi 5.8 6.31 6.8 PDSP Ki database
5-HT1B 5HT1B Rat 5-Hydroxytryptamine A pKi 7.07 7.47 8.3 PDSP Ki database
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pKi 6.61 6.9 7.19 PDSP Ki database
5-HT1A A0A4X1UTF5 Pig 5-Hydroxytryptamine A pKi 6.48 6.48 6.48 PDSP Ki database
5-HT1D 5HT1D Human 5-Hydroxytryptamine A pKi 5.26 5.34 5.43 PDSP Ki database
5-HT1D F1MMU1 Bovine 5-Hydroxytryptamine A pKi 5.0 5.35 5.5 PDSP Ki database
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 5.05 5.46 5.82 PDSP Ki database
5-HT2A 5HT2A Rat 5-Hydroxytryptamine A pKi 5.21 5.74 6.23 PDSP Ki database
5-HT2A 5HT2A Bovine 5-Hydroxytryptamine A pKi 5.6 5.6 5.6 PDSP Ki database
D1 DRD1 Human Dopamine A pKi 5.0 5.0 5.0 PDSP Ki database
D2 DRD2 Human Dopamine A pKi 5.0 5.0 5.0 PDSP Ki database
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 6.48 6.91 7.26 PDSP Ki database
5-HT1D 5HT1D Rat 5-Hydroxytryptamine A pKi 5.89 5.89 5.89 PDSP Ki database
β1 ADRB1 Human Adrenoceptors A pKi 8.57 9.63 10.7 PDSP Ki database
H1 HRH1 Human Histamine A pKi 5.0 5.0 5.0 PDSP Ki database
β2 ADRB2 Rat Adrenoceptors A pKi 5.0 6.8 8.61 PDSP Ki database
β2 ADRB2 Human Adrenoceptors A pKi 6.4 8.94 11.0 PDSP Ki database
β2 ADRB2 Guinea pig Adrenoceptors A pKi 9.08 9.09 9.1 PDSP Ki database
β1 H0W3H1 Guinea pig Adrenoceptors A pKi 8.28 8.28 8.28 PDSP Ki database
5-HT1B 5HT1B Guinea pig 5-Hydroxytryptamine A pKi 5.56 5.56 5.56 PDSP Ki database
β1 ADRB1 Rat Adrenoceptors A pKi 8.55 8.55 8.55 PDSP Ki database
5-HT1B 5HT1B Human 5-Hydroxytryptamine A pKi 6.19 6.63 7.07 PDSP Ki database
α2A ADA2A Human Adrenoceptors A pKi 6.0 6.0 6.0 PDSP Ki database
α2B ADA2B Human Adrenoceptors A pKi 6.0 6.0 6.0 PDSP Ki database
α2C ADA2C Human Adrenoceptors A pKi 6.0 6.0 6.0 PDSP Ki database
5-HT6 5HT6R Mouse 5-Hydroxytryptamine A pKi 5.0 5.0 5.0 PDSP Ki database
D1 DRD1 Bovine Dopamine A pKi 5.0 5.0 5.0 PDSP Ki database
5-HT5A 5HT5A Mouse 5-Hydroxytryptamine A pKi 5.0 5.0 5.0 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database