ocaperidone


SMILES Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)cccc2C
InChIKey ZZQNEJILGNNOEP-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 0
Rotatable bonds 4
Molecular weight (Da) 420.2

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug Yes

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 8.0 8.0 8.0 Guide to Pharmacology
5-HT1D 5HT1D Human 5-Hydroxytryptamine A pKi 8.7 8.75 8.8 Guide to Pharmacology
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 7.86 7.86 7.86 PDSP Ki database
D2 DRD2 Human Dopamine A pKi 9.4 9.7 10.0 PDSP Ki database
D3 DRD3 Human Dopamine A pKi 8.54 8.84 9.15 PDSP Ki database
D4 DRD4 Human Dopamine A pKi 8.18 8.18 8.18 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
5-HT1B 5HT1B Human 5-Hydroxytryptamine A pIC50 6.9 7.05 7.2 Guide to Pharmacology