CHEMBL4102616


SMILES CCCN(CCCCOc1ccc2ccnn2c1)[C@@H]1CCc2c(O)cccc2C1
InChIKey JQXMVFBXXAKVDC-OAQYLSRUSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 9
Molecular weight (Da) 393.2

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
D1 DRD1 Human Dopamine A pKi 5.07 5.07 5.07 ChEMBL
D4 DRD4 Human Dopamine A pKi 7.27 7.27 7.27 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 5.96 5.96 5.96 ChEMBL
D3 DRD3 Human Dopamine A pKi 7.96 7.96 7.96 ChEMBL
D2 DRD2 Human Dopamine A pKi 6.92 7.12 7.32 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D2 DRD2 Human Dopamine A pEC50 6.66 7.83 8.77 ChEMBL