CHEMBL1767165


SMILES COc1ccc(Cc2nn(C[C@H]3CCCN3CCCCc3ccc(OCCCN4CCCCCC4)cc3)c(=O)c3ccccc23)cc1
InChIKey AWKFJGDSZGEFRY-UUWRZZSWSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 0
Rotatable bonds 15
Molecular weight (Da) 636.4

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Sankey plot

Compound is not listed as a drug.

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
α1B ADA1B Human Adrenoceptors A pKi 7.3 7.3 7.3 ChEMBL
H1 HRH1 Human Histamine A pKi 8.1 8.1 8.1 ChEMBL
H1 HRH1 Human Histamine A pKd 8.9 8.9 8.9 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 7.2 7.2 7.2 ChEMBL
H3 HRH3 Human Histamine A pKi 9.5 9.5 9.5 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database