NIZATIDINE

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Synonyms
Status
Molecule Category Free-form
ATC A02BA04
UNII P41PML4GHR
EPA CompTox DTXSID5023376

Structure

InChI Key SGXXNSQHWDMGGP-UHFFFAOYSA-N
Smiles CNC(=C[N+](=O)[O-])NCCSCc1csc(CN(C)C)n1
InChI
InChI=1S/C12H21N5O2S2/c1-13-11(6-17(18)19)14-4-5-20-8-10-9-21-12(15-10)7-16(2)3/h6,9,13-14H,4-5,7-8H2,1-3H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C12H21N5O2S2
Molecular Weight 331.47
AlogP 1.32
Hydrogen Bond Acceptor 8.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 10.0
Polar Surface Area 83.33
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 21.0

Pharmacology

Mechanism of Action Action Reference
Histamine H2 receptor antagonist ANTAGONIST DailyMed

Target Conservation

Protein: Histamine H2 receptor
Description: Histamine H2 receptor
Organism : Homo sapiens
P25021 ENSG00000113749

Cross References

Resources Reference
ChEBI 7601
ChEMBL CHEMBL3183075
DrugBank DB00585
DrugCentral 1955
FDA SRS P41PML4GHR
SureChEMBL SCHEMBL770
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