CHEMBL476839


SMILES COc1c(OCCF)cccc1C(O)C1CCN(CCc2ccc(C)cc2)CC1
InChIKey MJKRYUCQHJLOIV-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 9
Molecular weight (Da) 401.2

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
5-HT1B 5HT1B Human 5-Hydroxytryptamine A pKi 5.31 5.31 5.31 ChEMBL
5-HT1D 5HT1D Human 5-Hydroxytryptamine A pKi 5.84 5.84 5.84 ChEMBL
α2C ADA2C Human Adrenoceptors A pKi 6.84 6.84 6.84 ChEMBL
H2 HRH2 Human Histamine A pKi 5.94 5.94 5.94 ChEMBL
5-HT7 5HT7R Human 5-Hydroxytryptamine A pKi 6.3 6.3 6.3 ChEMBL
H1 HRH1 Human Histamine A pKi 6.36 6.36 6.36 ChEMBL
5-HT2B 5HT2B Human 5-Hydroxytryptamine A pKi 6.33 6.33 6.33 ChEMBL
D1 DRD1 Human Dopamine A pKi 5.75 5.75 5.75 ChEMBL
D4 DRD4 Human Dopamine A pKi 5.57 5.57 5.57 ChEMBL
5-HT2C 5HT2C Human 5-Hydroxytryptamine A pKi 6.29 6.29 6.29 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database