CHEMBL4091155


SMILES O=C(CCCN1CCN(c2cccc(Cl)c2Cl)CC1)Nc1ccn2nccc2c1
InChIKey PELJKMLXUPTOKG-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 6
Molecular weight (Da) 431.1

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 6.62 6.62 6.62 ChEMBL
D4 DRD4 Human Dopamine A pKi 7.85 7.85 7.85 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 8.31 8.31 8.31 ChEMBL
D3 DRD3 Human Dopamine A pKi 8.25 8.25 8.25 ChEMBL
D2 DRD2 Human Dopamine A pKi 8.09 8.1 8.11 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D3 DRD3 Human Dopamine A pEC50 7.35 7.35 7.35 ChEMBL
D2 DRD2 Human Dopamine A pEC50 6.62 6.62 6.62 ChEMBL