CHEMBL4063282


SMILES COc1ccccc1N1CCN(CCCC(=O)Nc2ccn3nccc3c2)CC1
InChIKey LKXCWTFZOCKBJZ-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 7
Molecular weight (Da) 393.2

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D4 DRD4 Human Dopamine A pKi 7.85 7.85 7.85 ChEMBL
D1 DRD1 Human Dopamine A pKi 5.77 5.77 5.77 ChEMBL
D3 DRD3 Human Dopamine A pKi 7.01 7.01 7.01 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 6.51 6.51 6.51 ChEMBL
D2 DRD2 Human Dopamine A pKi 7.34 7.39 7.44 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D3 DRD3 Human Dopamine A pEC50 7.18 7.18 7.18 ChEMBL
D2 DRD2 Human Dopamine A pEC50 6.2 6.2 6.2 ChEMBL