CHEMBL490632


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

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 0
Rotatable bonds 9
Molecular weight (Da) 399.2

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
5-HT5A 5HT5A Human 5-Hydroxytryptamine A pKi 5.77 5.77 5.77 ChEMBL
5-HT1B 5HT1B Human 5-Hydroxytryptamine A pKi 5.47 5.47 5.47 ChEMBL
α2C ADA2C Human Adrenoceptors A pKi 6.81 6.81 6.81 ChEMBL
H2 HRH2 Human Histamine A pKi 6.08 6.08 6.08 ChEMBL
5-HT7 5HT7R Human 5-Hydroxytryptamine A pKi 6.14 6.14 6.14 ChEMBL
H1 HRH1 Human Histamine A pKi 6.18 6.18 6.18 ChEMBL
D4 DRD4 Human Dopamine A pKi 6.04 6.04 6.04 ChEMBL
D1 DRD1 Human Dopamine A pKi 5.71 5.71 5.71 ChEMBL
5-HT2B 5HT2B Human 5-Hydroxytryptamine A pKi 6.25 6.25 6.25 ChEMBL
H3 HRH3 Human Histamine A pKi 5.04 5.04 5.04 ChEMBL
5-HT2C 5HT2C Human 5-Hydroxytryptamine A pKi 6.3 6.3 6.3 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 5.72 5.72 5.72 ChEMBL
μ OPRM Human Opioid A pKi 5.7 5.7 5.7 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database