CHEMBL1190042


SMILES c1ccc(C2=NC[C@H](CN3CCN(c4ccccc4)CC3)N2)cc1
InChIKey QRYAMGGRUIKACE-GOSISDBHSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight (Da) 320.2

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 Bovine Dopamine A pKi 4.92 4.92 4.92 ChEMBL
D4 DRD4 Human Dopamine A pKi 7.14 7.82 9.02 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 7.35 7.35 7.35 ChEMBL
D3 DRD3 Human Dopamine A pKi 5.05 5.1 5.15 ChEMBL
D2 DRD2 Human Dopamine A pKi 4.85 4.95 5.0 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D4 DRD4 Human Dopamine A pEC50 7.51 7.51 7.51 ChEMBL