This drug entry is astuband has not been fully annotated. It is scheduled to be annotated soon.

Identification

Generic Name
Propenidazole
DrugBank Accession Number
DB13319
Background

Not Available

Type
Small Molecule
Groups
Experimental
Structure
Weight
Average: 267.241
Monoisotopic: 267.085520531
Chemical Formula
C11H13N3O5
Synonyms
  • Propenidazole

Pharmacology

Indication

Not Available

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Contraindications & Blackbox Warnings
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Pharmacodynamics

Not Available

Mechanism of action
Not Available
Absorption

Not Available

Volume of distribution

Not Available

Protein binding

Not Available

Metabolism
Not Available
Route of elimination

Not Available

Half-life

Not Available

Clearance

Not Available

Adverse Effects
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Toxicity

Not Available

Pathways
Not Available
Pharmacogenomic Effects/ADRsBrowse all" title="" id="snp-actions-info" class="drug-info-popup" href="javascript:void(0);">
Not Available

Interactions

Drug InteractionsLearn More" title="" id="structured-interactions-info" class="drug-info-popup" href="javascript:void(0);">
This information should not be interpreted without the help of a healthcare provider. If you believe you are experiencing an interaction, contact a healthcare provider immediately. The absence of an interaction does not necessarily mean no interactions exist.
Drug Interaction
阿曲库 The therapeutic efficacy of Atracurium can be increased when used in combination with Propenidazole.
阿曲库besylate The therapeutic efficacy of Atracurium besylate can be increased when used in combination with Propenidazole.
Botulinum toxin type A The therapeutic efficacy of Botulinum toxin type A can be increased when used in combination with Propenidazole.
Cisatracurium The therapeutic efficacy of Cisatracurium can be increased when used in combination with Propenidazole.
Decamethonium The therapeutic efficacy of Decamethonium can be increased when used in combination with Propenidazole.
Doxacurium The therapeutic efficacy of Doxacurium can be increased when used in combination with Propenidazole.
加拉碘铵 The therapeutic efficacy of Gallamine triethiodide can be increased when used in combination with Propenidazole.
Letibotulinumtoxina The therapeutic efficacy of Letibotulinumtoxina can be increased when used in combination with Propenidazole.
Metocurine The therapeutic efficacy of Metocurine can be increased when used in combination with Propenidazole.
Metocurine iodide The therapeutic efficacy of Metocurine iodide can be increased when used in combination with Propenidazole.
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Food Interactions
Not Available

Categories

ATC Codes
G01AF14 — Propenidazole P01AB05 — Propenidazole
Drug Categories
Chemical TaxonomyProvided byClassyfire
Description
This compound belongs to the class of organic compounds known as nitroimidazoles. These are compounds containing an imidazole ring which bears a nitro group.
Kingdom
Organic compounds
Super Class
Organoheterocyclic compounds
Class
Azoles
Sub Class
Imidazoles
Direct Parent
Nitroimidazoles
Alternative Parents
1,2,5-trisubstituted imidazoles/Imidazolyl carboxylic acids and derivatives/Nitroaromatic compounds/Beta-keto acids and derivatives/Fatty acid esters/Alpha-branched alpha,beta-unsaturated ketones/N-substituted imidazoles/Acryloyl compounds/Enoate esters/Enones
show 11 more
Substituents
1,2,5-trisubstituted-imidazole/Acryloyl-group/Allyl-type 1,3-dipolar organic compound/Alpha,beta-unsaturated carboxylic ester/Alpha,beta-unsaturated ketone/Alpha-branched alpha,beta-unsaturated-ketone/芳香的他teromonocyclic compound/Azacycle/Beta-keto acid/C-nitro compound
show 28 more
Molecular Framework
芳香的他teromonocyclic compounds
External Descriptors
Not Available
Affected organisms
Not Available

Chemical Identifiers

UNII
F0O89MB7QE
CAS number
76448-31-2
InChI Key
GCHKUUOPYMFGEY-VMPITWQZSA-N
InChI
InChI=1S/C11H13N3O5/c1-4-19-11(16)8(7(2)15)5-9-12-6-10(13(9)3)14(17)18/h5-6H,4H2,1-3H3/b8-5+
IUPAC Name
ethyl (2E)-2-[(1-methyl-5-nitro-1H-imidazol-2-yl)methylidene]-3-oxobutanoate
SMILES
CCOC(=O)C(=C\C1=NC=C(N1C)[N+]([O-])=O)\C(C)=O

References

General References
Not Available
ChemSpider
4950302
ChEBI
135098
ChEMBL
CHEMBL1788390
ZINC
ZINC000000001990
Wikipedia
Propenidazole

Clinical Trials

Clinical TrialsLearn More" title="" id="clinical-trials-info" class="drug-info-popup" href="javascript:void(0);">
Phase Status Purpose Conditions Count

Pharmacoeconomics

Manufacturers
Not Available
Packagers
Not Available
Dosage Forms
Not Available
Prices
Not Available
Patents
Not Available

Properties

State
Not Available
Experimental Properties
Not Available
Predicted Properties
Property Value Source
Water Solubility 0.344 mg/mL ALOGPS
logP 1.11 ALOGPS
logP 1.15 Chemaxon
logS -2.9 ALOGPS
pKa (Strongest Acidic) 18.17 Chemaxon
pKa (Strongest Basic) 1.38 Chemaxon
Physiological Charge 0 Chemaxon
Hydrogen Acceptor Count 5 Chemaxon
Hydrogen Donor Count 0 Chemaxon
Polar Surface Area 104.33 Å2 Chemaxon
Rotatable Bond Count 6 Chemaxon
Refractivity 65.03 m3·mol-1 Chemaxon
Polarizability 25.72 Å3 Chemaxon
Number of Rings 1 Chemaxon
生物利用度 1 Chemaxon
Rule of Five Yes Chemaxon
Ghose Filter Yes Chemaxon
Veber's Rule No Chemaxon
MDDR-like Rule No Chemaxon
Predicted ADMET Features
Not Available

Spectra

Mass Spec (NIST)
Not Available
Spectra
Spectrum Spectrum Type Splash Key
Predicted GC-MS Spectrum - GC-MS Predicted GC-MS Not Available
Predicted MS/MS Spectrum - 10V, Positive (Annotated) Predicted LC-MS/MS Not Available
Predicted MS/MS Spectrum - 20V, Positive (Annotated) Predicted LC-MS/MS Not Available
Predicted MS/MS Spectrum - 40V, Positive (Annotated) Predicted LC-MS/MS Not Available
Predicted MS/MS Spectrum - 10V, Negative (Annotated) Predicted LC-MS/MS Not Available
Predicted MS/MS Spectrum - 20V, Negative (Annotated) Predicted LC-MS/MS Not Available
Predicted MS/MS Spectrum - 40V, Negative (Annotated) Predicted LC-MS/MS Not Available

Drug created at June 23, 2017 20:39 / Updated at February 21, 2021 18:54