(1-Hydroxy-2-oxopiperidin-3-yl)phosphonic acid
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This drug entry is a stub and has not been fully annotated. It is scheduled to be annotated soon.
Identification
- Generic Name
- (1-Hydroxy-2-oxopiperidin-3-yl)phosphonic acid
- DrugBank Accession Number
- DB17108
- Background
Not Available
- Type
- Small Molecule
- Groups
- Investigational
- Structure
- Weight
- Average: 195.111
Monoisotopic: 195.029659424 - Chemical Formula
- C5H10NO5P
- Synonyms
- Phosphonic acid, p-(1-hydroxy-2-oxo-3-piperidinyl)-
Pharmacology
- Indication
Not Available
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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
- Improve decision support & research outcomesWith structured adverse effects data, including: blackbox warnings, adverse reactions, warning & precautions, & incidence rates. View sample adverse effects data in our new Data Library!Improve decision support & research outcomes with our structured adverse effects data.
- 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
- Drug Categories
- Not Available
- Classification
- Not classified
- Affected organisms
- Not Available
Chemical Identifiers
- UNII
- 64T5RTG4MY
- CAS number
- 2004714-32-1
- InChI Key
- DVZQUMSQEGOYMX-UHFFFAOYSA-N
- InChI
- InChI=1S/C5H10NO5P/c7-5-4(12(9,10)11)2-1-3-6(5)8/h4,8H,1-3H2,(H2,9,10,11)
- IUPAC Name
- (1-hydroxy-2-oxopiperidin-3-yl)phosphonic acid
- SMILES
- ON1CCCC(C1=O)P(O)(O)=O
References
- General References
- Not Available
- External Links
- ChemSpider
- 81367194
- BindingDB
- 50543109
- ChEMBL
- CHEMBL4647387
Clinical Trials
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 38.8 mg/mL ALOGPS logP -0.87 ALOGPS logP -1.7 Chemaxon logS -0.7 ALOGPS pKa (Strongest Acidic) 1.6 Chemaxon pKa (Strongest Basic) -5.7 Chemaxon Physiological Charge -1 Chemaxon Hydrogen Acceptor Count 5 Chemaxon Hydrogen Donor Count 3 Chemaxon Polar Surface Area 98.07 Å2 Chemaxon Rotatable Bond Count 1 Chemaxon Refractivity 39.4 m3·mol-1 Chemaxon Polarizability 16.01 Å3 Chemaxon Number of Rings 1 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter No 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 1H NMR Spectrum 1D NMR Not Applicable Predicted 13C NMR Spectrum 1D NMR Not Applicable - Chromatographic Properties
Collision Cross Sections (CCS)
Not Available
Drug created at November 14, 2022 22:23 / Updated at December 01, 2022 11:35