CHEMBL1910141


SMILES COc1ccccc1N1CCN(CCN(C(=O)C23CCC(CF)(CC2)C3)c2ccccn2)CC1
InChIKey PSWXVBZJWHEKPU-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 0
Rotatable bonds 8
Molecular weight (Da) 466.3

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
5-HT1D 5HT1D Human 5-Hydroxytryptamine A pKi 7.04 7.04 7.04 ChEMBL
α1B ADA1B Human Adrenoceptors A pKi 7.42 7.42 7.42 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 7.44 7.44 7.44 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 7.72 7.72 7.72 ChEMBL
5-HT7 5HT7R Human 5-Hydroxytryptamine A pKi 7.01 7.01 7.01 ChEMBL
5-HT2B 5HT2B Human 5-Hydroxytryptamine A pKi 7.06 7.06 7.06 ChEMBL
D4 DRD4 Human Dopamine A pKi 7.04 7.04 7.04 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 9.05 9.06 9.07 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pIC50 8.7 8.7 8.7 ChEMBL