CHEMBL5315483


SMILES COCCC(=O)NCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O
InChIKey BTFVTAWVFBWGHC-OAQYLSRUSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 10
Molecular weight (Da) 482.2

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
H1 HRH1 Human Histamine A pKi 9.1 9.1 9.1 ChEMBL
H1 HRH1 Human Histamine A pKd 9.3 9.3 9.3 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 8.1 8.1 8.1 ChEMBL
α1B ADA1B Human Adrenoceptors A pKi 7.2 7.2 7.2 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database