CHEMBL146246


SMILES NS(=O)(=O)c1ccc(N2CCN(CCC3OCCc4ccccc43)CC2)cc1
InChIKey WNUQCGWXPNGORO-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 5
Molecular weight (Da) 401.2

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
D4 DRD4 Human Dopamine A pKi 8.44 8.44 8.44 ChEMBL
D2 DRD2 Human Dopamine A pKi 5.29 5.29 5.29 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 5.46 5.46 5.46 PDSP Ki database
5-HT6 5HT6R Human 5-Hydroxytryptamine A pKi 5.0 5.0 5.0 PDSP Ki database
5-HT2A 5HT2A Rat 5-Hydroxytryptamine A pKi 5.79 5.79 5.79 PDSP Ki database
D3 DRD3 Rat Dopamine A pKi 5.56 5.56 5.56 PDSP Ki database
H1 HRH1 Bovine Histamine A pKi 5.13 5.13 5.13 PDSP Ki database
D1 DRD1 Rat Dopamine A pKi 5.08 5.08 5.08 PDSP Ki database
D4 DRD4 Rat Dopamine A pKi 8.44 8.44 8.44 PDSP Ki database
D2 DRD2 Rat Dopamine A pKi 5.29 5.29 5.29 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database