pyrovalerone


SMILES CCCC(C(=O)C1=CC=C(C=C1)C)N2CCCC2
InChIKey SWUVZKWCOBGPTH-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 5
Molecular weight (Da) 245.2

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 4.87 4.87 4.87 PDSP Ki database
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 4.89 4.89 4.89 PDSP Ki database
5-HT2C 5HT2C Human 5-Hydroxytryptamine A pKi 4.89 4.89 4.89 PDSP Ki database
TA1 TAAR1 Rat Trace amine A pKi 4.9 4.9 4.9 PDSP Ki database
TA1 TAAR1 Mouse Trace amine A pKi 5.0 5.0 5.0 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database