CHEMBL4173095


SMILES C=C(C)CN1CCN(c2ccc3c(c2)CN(C(=O)OCc2ccccc2)CC3)CC1
InChIKey BOIPWYRNMCLWCD-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 0
Rotatable bonds 5
Molecular weight (Da) 405.2

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
5-HT1E 5HT1E Human 5-Hydroxytryptamine A pKi 5.91 5.91 5.91 ChEMBL
α2B ADA2B Human Adrenoceptors A pKi 5.61 5.61 5.61 ChEMBL
H2 HRH2 Human Histamine A pKi 6.01 6.01 6.01 ChEMBL
α2A ADA2A Human Adrenoceptors A pKi 6.06 6.06 6.06 ChEMBL
H1 HRH1 Human Histamine A pKi 6.06 6.06 6.06 ChEMBL
H3 HRH3 Human Histamine A pKi 5.55 5.55 5.55 ChEMBL
5-HT2C 5HT2C Human 5-Hydroxytryptamine A pKi 5.87 5.87 5.87 ChEMBL
D3 DRD3 Human Dopamine A pKi 6.58 6.58 6.58 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database