PANTOPRAZOLE SODIUM

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Trade Names
Synonyms
Status
Molecule Category Salt-form
UNII 6871619Q5X
Parent Compound: PANTOPRAZOLE

Structure

InChI Key CGJRLPRCWSHOFU-UHFFFAOYSA-N
Smiles COc1ccnc(C[S+]([O-])c2nc3cc(OC(F)F)ccc3[n-]2)c1OC.O.[Na+]
InChI
InChI=1S/C16H14F2N3O4S.Na.H2O/c1-23-13-5-6-19-12(14(13)24-2)8-26(22)16-20-10-4-3-9(25-15(17)18)7-11(10)21-16;;/h3-7,15H,8H2,1-2H3;;1H2/q-1;+1;

Physicochemical Descriptors

Property Name Value
Molecular Formula C16H16F2N3NaO5S
Molecular Weight 423.37
AlogP 2.88
Hydrogen Bond Acceptor 6.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 7.0
Polar Surface Area 86.33
Molecular species NEUTRAL
Aromatic Rings 3.0
Heavy Atoms 26.0

Pharmacology

Mechanism of Action Action Reference
Potassium-transporting ATPase inhibitor INHIBITOR PubMed PubMed DailyMed

Target Conservation

Protein: Potassium-transporting ATPase
Description: Potassium-transporting ATPase alpha chain 1
Organism : Homo sapiens
P20648 ENSG00000105675
Protein: Potassium-transporting ATPase
Description: Potassium-transporting ATPase subunit beta
Organism : Homo sapiens
P51164 ENSG00000186009

Cross References

Resources Reference
ChEMBL CHEMBL3989559
FDA SRS 6871619Q5X
PubChem 11954257
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