CHEMBL233584


SMILES COc1ccc(S(=O)(=O)N[C@H]2CC[C@@H](N3CCN(c4ccccc4OCC4CC4)CC3)CC2)cc1OC
InChIKey HBVMKSZWZCERSH-ZRZAMGCNSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 10
Molecular weight (Da) 529.3

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 6.44 6.44 6.44 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 6.72 6.72 6.72 ChEMBL
D2 DRD2 Human Dopamine A pKi 6.91 6.91 6.91 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 7.19 7.19 7.19 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database