CHEMBL3893197


SMILES c1cnc2c(N3CCN(CCCCc4ccc(OCCCN5CCCCCC5)cc4)CC3)cccc2c1
InChIKey HKPKDTNLXGOYIC-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 0
Rotatable bonds 11
Molecular weight (Da) 500.4

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
α1B ADA1B Human Adrenoceptors A pKi 7.3 7.3 7.3 ChEMBL
H1 HRH1 Human Histamine A pKd 8.3 8.3 8.3 ChEMBL
H1 HRH1 Human Histamine A pKi 7.8 7.8 7.8 ChEMBL
H3 HRH3 Human Histamine A pKi 9.2 9.2 9.2 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 7.1 7.1 7.1 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database