CHEMBL234476


SMILES O=S(=O)(N[C@H]1CC[C@@H](N2CCN(c3ccccc3OCC3CC3)CC2)CC1)c1cc(Cl)ccc1F
InChIKey BQRCXSWHZYCROY-SZPZYZBQSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 8
Molecular weight (Da) 521.2

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 Human Adrenoceptors A pKi 6.02 6.02 6.02 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 7.36 7.36 7.36 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 7.44 7.44 7.44 ChEMBL
D2 DRD2 Human Dopamine A pKi 6.37 6.37 6.37 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database