pimavanserin [6356]



pimavanserin


SMILES CC(C)COc1ccc(CNC(=O)N(Cc2ccc(F)cc2)C2CCN(C)CC2)cc1
InChIKey RKEWSXXUOLRFBX-UHFFFAOYSA-N

Chemical Properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 8
Log P 4.666
Molecular weight (Da) 427.3
Stereochemistry info unspecified

Database connections

Structure pdb 9UJM 8ZMG
Model (Boltz2) 5-HT2A
Ligand site mutations 5-HT2A

Bioactivities

Receptor Activity Source
Protein Gene Species Family Class Type Min Avg Max Database
Receptor Activity Source
Protein Gene Species Family Class Type Min Avg Max Database

pimavanserin


Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug Yes

Distribution across phases (no. indications)

Phase I 1
Phase II 1
Phase III 3
Phase IV 2

Database connections

Structure pdb 9UJM 8ZMG
Model (Boltz2) 5-HT2A
Ligand site mutations 5-HT2A

Sankey plot

Drug Information

Target Disease
Gene Protein Receptor family Ligand type Class Name Phase ICD11 ATC Association score