nemonapride


SMILES CNC1=CC(OC)=C(C=C1Cl)C(=O)N[C@@H]1CCN(CC2=CC=CC=C2)[C@@H]1C
InChIKey KRVOJOCLBAAKSJ-RDTXWAMCSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 6
Molecular weight (Da) 387.2

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug Yes

Database connections

Structure pdb 5WIU 5WIV

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D4 DRD4 Human Dopamine A pKd 8.01 8.01 8.01 Drug Central
D3 DRD3 Human Dopamine A pKi 8.03 8.03 8.03 Drug Central
D3 DRD3 Rat Dopamine A pKi 8.01 8.01 8.01 Drug Central
D2 DRD2 Rat Dopamine A pKi 8.01 8.01 8.01 Drug Central
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
5-HT2A 5HT2A Rat 5-Hydroxytryptamine A pIC50 8.14 8.14 8.14 Drug Central
α1A ADA1A Rat Adrenoceptors A pIC50 8.2 8.2 8.2 Drug Central