CHEMBL8617


SMILES COc1cccc2c1C(CCCN1CCN(c3ccccn3)CC1)=CCC2
InChIKey LFPMDBSDZKZDIJ-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 0
Rotatable bonds 6
Molecular weight (Da) 363.2

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
D2 DRD2 Rat Dopamine A pKi 7.53 7.53 7.53 ChEMBL
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pKi 8.9 8.9 8.9 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D2 DRD2 Rat Dopamine A pIC50 6.92 6.92 6.92 ChEMBL
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pIC50 8.85 8.85 8.85 ChEMBL