CHEMBL43905


SMILES COc1cccc(OC)c1OCCNCC1CC(c2ccccc2)c2ccccc2S1
InChIKey JGLLHUJRQIQLNY-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 9
Molecular weight (Da) 435.2

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
α1B ADA1B Rat Adrenoceptors A pKd 6.81 6.81 6.81 ChEMBL
α1A ADA1A Rat Adrenoceptors A pKd 8.21 8.26 8.31 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 9.36 9.36 9.36 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 10.05 10.05 10.05 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 7.82 7.82 7.82 ChEMBL
α1B ADA1B Human Adrenoceptors A pKi 8.94 8.94 8.94 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database