CHEMBL233816


SMILES COc1ccc(Cl)cc1S(=O)(=O)N[C@H]1CC[C@@H](N2CCN(c3ccccc3OC(C)C)CC2)CC1
InChIKey XRCQNHQVZIQOBE-SZPZYZBQSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 8
Molecular weight (Da) 521.2

Drug properties

Molecular type Small molecule
Endogenous/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 6.4 6.76 7.11 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 7.96 8.48 9.0 ChEMBL
D2 DRD2 Human Dopamine A pKi 6.59 6.79 7.0 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 7.92 8.52 9.12 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database