paliperidone   Click here for help

GtoPdb Ligand ID: 7258

Synonyms: 9-hydroxyrisperidone | Invega® | Ro-76477 | Ro-92670
Approved drug
paliperidone is an approved drug (FDA (2006), EMA (2007))
Compound class: Synthetic organic
Comment: Paliperidone is an atypical antipsychotic. Mechanistically it is a dopamine receptor and 5-HT2A receptor antagonist.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 4
Topological polar surface area 84.39
Molecular weight 426.21
XLogP 2.96
No. Lipinski's rules broken 0
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Canonical SMILES Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2O
Isomeric SMILES Fc1ccc2c(c1)onc2C1CCN(CC1)CCc1c(C)nc2n(c1=O)CCCC2O
InChI InChI=1S/C23H27FN4O3/c1-14-17(23(30)28-9-2-3-19(29)22(28)25-14)8-12-27-10-6-15(7-11-27)21-18-5-4-16(24)13-20(18)31-26-21/h4-5,13,15,19,29H,2-3,6-12H2,1H3
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes (FDA (2006), EMA (2007))
WHO Essential Medicine WHO Essential Medicines List (EML) (23rd List, 2023). Access PDF version.
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Prodrug risperidone
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
7977 paliperidone
Synonyms Click here for help
9-hydroxyrisperidone | Invega® | Ro-76477 | Ro-92670
Database Links Click here for help
CAS Registry No. 144598-75-4
ChEMBL Ligand CHEMBL1621
DrugBank Ligand DB01267
DrugCentral Ligand 4137
GtoPdb PubChem SID 178103832
PubChem CID 115237
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Wikipedia Paliperidone

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Paliperidone (links to external site)
Cat. No. 4493