CHEMBL605081


SMILES Cc1ccc(CCn2c3c(c4cc(C)ccc42)CN(C)CC3)cc1
InChIKey KRPHBUMURAALTO-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 3
Molecular weight (Da) 318.2

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
α1A ADA1A Human Adrenoceptors A pKi 8.15 8.15 8.15 ChEMBL
5-HT7 5HT7R Human 5-Hydroxytryptamine A pKi 9.41 9.41 9.41 ChEMBL
α2A ADA2A Human Adrenoceptors A pKi 9.09 9.09 9.09 ChEMBL
5-HT6 5HT6R Human 5-Hydroxytryptamine A pKi 8.62 8.62 8.62 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 8.96 8.96 8.96 ChEMBL
5-HT2C 5HT2C Human 5-Hydroxytryptamine A pKi 8.8 8.8 8.8 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
H1 HRH1 Human Histamine A pIC50 6.95 6.95 6.95 ChEMBL
5-HT6 5HT6R Human 5-Hydroxytryptamine A pIC50 6.56 6.56 6.56 ChEMBL