CHEMBL3917428


SMILES O=C(O)CCc1ccc2cc(Cc3ccccc3)cc(N3CCN(CCc4ccc(OCCCN5CCCCCC5)cc4)CC3)c2n1
InChIKey FZTMDWIJTHPEMP-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 14
Molecular weight (Da) 634.4

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 6.6 6.6 6.6 ChEMBL
H1 HRH1 Human Histamine A pKd 8.2 8.2 8.2 ChEMBL
H1 HRH1 Human Histamine A pKi 7.6 7.6 7.6 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 7.3 7.3 7.3 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