CHEMBL9841


SMILES Clc1ccccc1N1CCNCC1
InChIKey PWZDJIUQHUGFRJ-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 1
Molecular weight (Da) 196.1

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
α2A ADA2A Bovine Adrenoceptors A pKi 7.6 7.6 7.6 ChEMBL
α1A ADA1A Bovine Adrenoceptors A pKi 6.8 6.8 6.8 ChEMBL
5-HT1B 5HT1B Rat 5-Hydroxytryptamine A pKi 7.93 7.93 7.93 ChEMBL
α1A ADA1A Rat Adrenoceptors A pKi 6.15 6.15 6.15 ChEMBL
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pKi 6.65 7.18 7.71 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
β2 ADRB2 Dog Adrenoceptors A pIC50 4.8 4.8 4.8 ChEMBL
β1 ADRB1 Human Adrenoceptors A pIC50 4.92 4.92 4.92 ChEMBL