CHEMBL3898341


SMILES CCCCc1cc(N2CCN(CCc3ccc(OCCCN4CCCCCC4)cc3)CC2)c2nc(CCC(=O)O)ccc2c1
InChIKey JQNSYTMOXNMQTB-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 15
Molecular weight (Da) 600.4

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
α1B ADA1B Human Adrenoceptors A pKi 6.4 6.4 6.4 ChEMBL
H1 HRH1 Human Histamine A pKd 8.8 8.8 8.8 ChEMBL
H1 HRH1 Human Histamine A pKi 7.9 7.9 7.9 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 6.5 6.5 6.5 ChEMBL
H3 HRH3 Human Histamine A pKi 9.1 9.1 9.1 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database