CHEMBL442059


SMILES COc1ccc(Cl)cc1S(=O)(=O)N[C@H]1CC[C@@H](N2CCC(c3ccccc3OCC(F)(F)F)CC2)CC1
InChIKey WDZOSSNSOBKEMP-OYRHEFFESA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 8
Molecular weight (Da) 560.2

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 6.67 6.67 6.67 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 8.8 8.8 8.8 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 8.21 8.21 8.21 ChEMBL
D2 DRD2 Human Dopamine A pKi 7.16 7.16 7.16 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database