(+)-AJ76


SMILES CCCN[C@@H]1CCc2c([C@@H]1C)cccc2OC
InChIKey YGHLYBIUVOLKCV-SMDDNHRTSA-N

Chemical properties

Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight (Da) 233.2

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Ligand site mutations D3

Sankey plot

Compound is not listed as a drug.

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D3 DRD3 Human Dopamine A pKi 5.9 6.05 6.2 Guide to Pharmacology
D2 DRD2 Rat Dopamine A pKi 6.28 6.52 6.75 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 6.39 6.39 6.39 ChEMBL
5-HT5A 5HT5A Human 5-Hydroxytryptamine A pKi 5.63 5.63 5.63 ChEMBL
D2 DRD2 Human Dopamine A pKi 6.84 7.34 7.85 ChEMBL
D3 DRD3 Human Dopamine A pKi 7.16 7.44 7.58 ChEMBL
D4 DRD4 Human Dopamine A pKi 6.93 6.93 6.93 ChEMBL
D2 DRD2 Bovine Dopamine A pKi 6.8 6.82 6.84 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database