CHEMBL4129589


SMILES c1ccc2c(OCCCCCN3CCCCCC3)cccc2c1
InChIKey CDPGITMKSDQGJF-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 7
Molecular weight (Da) 311.2

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
H1 HRH1 Guinea pig Histamine A pKd 6.15 6.15 6.15 ChEMBL
H3 HRH3 Human Histamine A pKi 7.66 7.66 7.66 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 5.58 5.58 5.58 ChEMBL
5-HT6 5HT6R Human 5-Hydroxytryptamine A pKi 5.74 5.74 5.74 ChEMBL
5-HT7 5HT7R Human 5-Hydroxytryptamine A pKi 5.55 5.55 5.55 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
H3 HRH3 Human Histamine A pIC50 6.51 6.51 6.51 ChEMBL