pantoprazole

Ligand id: 7260

Name: pantoprazole

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 7
Topological polar surface area 105.54
Molecular weight 383.08
XLogP 1.03
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (FDA (2000))
IUPAC Name
6-(difluoromethoxy)-2-[(3,4-dimethoxypyridin-2-yl)methanesulfinyl]-1H-1,3-benzodiazole
International Nonproprietary Names
INN number INN
6548 pantoprazole
Synonyms
BY-1023 | Protonix® | SK-96022
Database Links
BitterDB Ligand 934
CAS Registry No. 102625-70-7
ChEMBL Ligand CHEMBL1502
DrugBank Ligand DB00213
PubChem CID 4679
Search Google for chemical match using the InChIKey IQPSEEYGBUAQFF-UHFFFAOYSA-N
Search Google for chemicals with the same backbone IQPSEEYGBUAQFF
Search PubMed clinical trials pantoprazole
Search PubMed titles pantoprazole
Search PubMed titles/abstracts pantoprazole
Search UniChem for chemical match using the InChIKey IQPSEEYGBUAQFF-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone IQPSEEYGBUAQFF
Wikipedia Pantoprazole
Comments
Pantoprazole is a proton pump inhibitor.
Marketed formulations may contain pantoprazole sodium (PubChem CID 15008962) or pantoprazole sodium sesquihydrate (PubChem CID 23690067).