In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 9th, 2014 | 0 | Yes |
Popular Name: Pantoprazole sodium Pantoprazole sodium
Find On: PubMed — Wikipedia — Google
CAS Numbers: , 102625-70-7 , 138786-67-1 , [138786-67-1]
1H-benzimidazole, 5-(difluoromethoxy)-2-[[(3,4-dimethoxy-2-pyridinyl)methyl]sulfinyl]-, sodium salt
1H-Benzimidazole, 6-(difluoromethoxy)-2-[[(3,4-dimethoxy-2-pyridinyl)methyl]sulfinyl]-
5-(Difluoromethoxy)-2-(((3,4-dimethoxy-2-pyridinyl)methyl) sulfinyl)-1H-benzimidazole sodium
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 1.95 | 2.47 | -16.78 | 1 | 7 | 0 | 86 | 383.376 | 7 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Indications | antiulcerative | KeyOrganics Bioactives |
Indications | antiulcerative, gastroesophageal reflux disease (GERD) | KeyOrganics Bioactives |
Patent Database Links | EP0998944; EP1000943; EP1222922; EP1466897; EP1518857; EP1525882; EP1552833; EP1602362; EP1611901; EP1616562; EP1652514; EP1681052; EP1721604; EP1728512; EP1731141; EP1747776; EP1747800; EP1762249; EP1795530; EP1803450; EP1837016; EP1875911; EP1897556; EP | ChEBI |
Patent Database Links | EP1598347; EP1795530; US2005004172; US2007196444; US2008262043; WO2006064249 | ChEBI |
No pre-computed analogs available. Try a structural similarity search.