Tebipenem pivoxil

This drug entry is a stub and has not been fully annotated. It is scheduled to be annotated soon.

Identification

Generic Name
Tebipenem pivoxil
DrugBank Accession Number
DB16840
Background

Not Available

Type
Small Molecule
Groups
Investigational
Structure
Weight
Average: 497.63
Monoisotopic: 497.165428078
Chemical Formula
C22H31N3O6S2
Synonyms
  • Tebipenem pivoxil
External IDs
  • L-084
  • LJC-11084
  • ME-1211
  • ME1211

Pharmacology

Indication

Not Available

Reduce drug development failure rates
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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/ADRs
Not Available

Interactions

Drug Interactions
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.
Not Available
Food Interactions
Not Available

Categories

ATC Codes
J01DH06 — Tebipenem pivoxil
Drug Categories
Classification
Not classified
Affected organisms
Not Available

Chemical Identifiers

UNII
95AK1A52I8
CAS number
161715-24-8
InChI Key
SNUDIPVBUUXCDG-QHSBEEBCSA-N
InChI
InChI=1S/C22H31N3O6S2/c1-11-15-14(12(2)26)18(27)25(15)16(19(28)30-10-31-20(29)22(3,4)5)17(11)33-13-8-24(9-13)21-23-6-7-32-21/h11-15,26H,6-10H2,1-5H3/t11-,12-,14-,15-/m1/s1
IUPAC Name
[(4R,5S,6S)-3-{[1-(4,5-dihydro-1,3-thiazol-2-yl)azetidin-3-yl]sulfanyl}-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carbonyloxy]methyl 2,2-dimethylpropanoate
SMILES
[H][C@]12[C@@H](C)C(SC3CN(C3)C3=NCCS3)=C(N1C(=O)[C@]2([H])[C@@H](C)O)C(=O)OCOC(=O)C(C)(C)C

References

General References
Not Available
ChemSpider
8067741
ChEBI
135799
ChEMBL
CHEMBL2107486
ZINC
ZINC000004217736
Wikipedia
Tebipenem

Clinical Trials

Clinical Trials
PhaseStatusPurposeConditionsCount
2RecruitingTreatmentShigellosis1

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
PropertyValueSource
Water Solubility0.167 mg/mLALOGPS
logP2.63ALOGPS
logP1.59Chemaxon
logS-3.5ALOGPS
pKa (Strongest Acidic)15Chemaxon
pKa (Strongest Basic)6.27Chemaxon
Physiological Charge0Chemaxon
Hydrogen Acceptor Count6Chemaxon
Hydrogen Donor Count1Chemaxon
Polar Surface Area108.74 Å2Chemaxon
Rotatable Bond Count9Chemaxon
Refractivity127.43 m3·mol-1Chemaxon
Polarizability53.39 Å3Chemaxon
Number of Rings4Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterNoChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleYesChemaxon
Predicted ADMET Features
Not Available

Spectra

Mass Spec (NIST)
Not Available
Spectra
SpectrumSpectrum TypeSplash Key
Predicted MS/MS Spectrum - 10V, Positive (Annotated)Predicted LC-MS/MSsplash10-00kb-0007900000-299ccf8e25d05a8d4f56
Predicted MS/MS Spectrum - 10V, Negative (Annotated)Predicted LC-MS/MSsplash10-0f92-2394400000-d6a4f31770e432e57e89
Predicted MS/MS Spectrum - 20V, Positive (Annotated)Predicted LC-MS/MSsplash10-014j-2009300000-4d0bf6e9cac9bfdd3b11
Predicted MS/MS Spectrum - 20V, Negative (Annotated)Predicted LC-MS/MSsplash10-02dj-1179300000-cfd3da24f61d2b08c373
Predicted MS/MS Spectrum - 40V, Positive (Annotated)Predicted LC-MS/MSsplash10-0n2a-4219500000-c26f268d4c7cdfa8bd48
Predicted MS/MS Spectrum - 40V, Negative (Annotated)Predicted LC-MS/MSsplash10-0006-1094400000-e2dd8c69391ce1c97078
Predicted 1H NMR Spectrum1D NMRNot Applicable
Predicted 13C NMR Spectrum1D NMRNot Applicable
Chromatographic Properties
Collision Cross Sections (CCS)
AdductCCS Value (Å2)Source typeSource
[M-H]-225.0170319
predicted
DarkChem Lite v0.1.0
[M+H]+227.1041319
predicted
DarkChem Lite v0.1.0
[M+Na]+226.1346319
predicted
DarkChem Lite v0.1.0

Drug created at July 18, 2022 19:55 / Updated at December 01, 2022 11:31