ILAPRAZOLE

Search structure
Synonyms:
Status: Approved
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 776Q6XX45J

Structure
InChI Key HRRXCXABAPSOCP-UHFFFAOYSA-N
Smile COc1ccnc(C[S+]([O-])c2nc3cc(-n4cccc4)ccc3[nH]2)c1C
InChI
InChI=1S/C19H18N4O2S/c1-13-17(20-8-7-18(13)25-2)12-26(24)19-21-15-6-5-14(11-16(15)22-19)23-9-3-4-10-23/h3-11H,12H2,1-2H3,(H,21,22)

Physicochemical Descriptors

Property Name Value
Molecular Formula C19H18N4O2S
Molecular Weight 366.45
AlogP 3.37
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 5.0
Polar Surface Area 72.8
Molecular species NEUTRAL
Aromatic Rings 4.0
Heavy Atoms 26.0

Pharmacology

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

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Duodenal Ulcer 3 D004381 ClinicalTrials
Gastroesophageal Reflux 3 D005764 ClinicalTrials
Peptic Ulcer 3 D010437 ClinicalTrials
Hemorrhage 3 D006470 ClinicalTrials

Related Entries

MCS

Scaffolds

Cross References

Resources Reference
CAS NUMBER 172152-36-2
ChEBI 135544
ChEMBL CHEMBL2106370
DrugBank DB11964
DrugCentral 3961
FDA SRS 776Q6XX45J
Guide to Pharmacology 10512
PharmGKB PA165947499
PubChem 214351
SureChEMBL SCHEMBL1179039
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