CHEMBL4595150


SMILES CCCN(CCCCNC(=O)c1ccc(-c2ccccn2)cc1)C[C@@H]1C[C@H]1c1cccc(Cl)c1Cl
InChIKey NRXPFRHREANWEK-UKILVPOCSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 12
Molecular weight (Da) 509.2

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 5.87 5.87 5.87 ChEMBL
D4 DRD4 Human Dopamine A pKi 6.17 6.17 6.17 ChEMBL
5-HT2C 5HT2C Human 5-Hydroxytryptamine A pKi 6.38 6.38 6.38 ChEMBL
D3 DRD3 Human Dopamine A pKi 8.82 8.82 8.82 ChEMBL
D2 DRD2 Human Dopamine A pKi 6.26 6.26 6.26 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
5-HT2C 5HT2C Human 5-Hydroxytryptamine A pIC50 5.0 5.0 5.0 ChEMBL
D3 DRD3 Human Dopamine A pEC50 7.9 7.9 7.9 ChEMBL