CHEMBL1242912


SMILES COc1ccccc1N1CCN(C[C@H]2CO[C@@](CN3C(=O)CC4(CCCC4)CC3=O)(c3ccccc3)O2)CC1
InChIKey MZMIENIIBMNHDS-VVFBEHOQSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 0
Rotatable bonds 7
Molecular weight (Da) 533.3

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 8.03 8.03 8.03 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 8.69 8.69 8.69 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 8.32 8.32 8.32 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 8.58 8.58 8.58 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database