Antineoplaston A10
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This drug entry is a stub and has not been fully annotated. It is scheduled to be annotated soon.
Explore a selection of our essential drug information below, or:
Identification
- Generic Name
- Antineoplaston A10
- DrugBank Accession Number
- DB11702
- Background
Antineoplaston A10 has been used in trials studying the treatment of Sarcoma, Lymphoma, Lung Cancer, Liver Cancer, and Kidney Cancer, among others.
- Type
- Small Molecule
- Groups
- Investigational
- Structure
- Weight
- Average: 246.266
Monoisotopic: 246.100442319 - Chemical Formula
- C13H14N2O3
- Synonyms
- Antineoplaston A 10
- ATENGENAL
- BENZENEACETAMIDE, N-((3S)-2,6-DIOXO-3-PIPERIDINYL)-
- BENZENEACETAMIDE, N-(2,6-DIOXO-3-PIPERIDINYL)-, (S)-
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
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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
- Drug Categories
- Chemical TaxonomyProvided by Classyfire
- Description
- This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.
- Kingdom
- Organic compounds
- Super Class
- Organic acids and derivatives
- Class
- Carboxylic acids and derivatives
- Sub Class
- Amino acids, peptides, and analogues
- Direct Parent
- N-acyl-alpha amino acids and derivatives
- Alternative Parents
- Phenylacetamides / Piperidinediones / Delta lactams / N-unsubstituted carboxylic acid imides / Dicarboximides / Secondary carboxylic acid amides / Azacyclic compounds / Organopnictogen compounds / Organonitrogen compounds / Organic oxides show 2 more
- Substituents
- Aromatic heteromonocyclic compound / Azacycle / Benzenoid / Carbonyl group / Carboxamide group / Carboxylic acid imide / Carboxylic acid imide, n-unsubstituted / Delta-lactam / Dicarboximide / Hydrocarbon derivative show 15 more
- Molecular Framework
- Aromatic heteromonocyclic compounds
- External Descriptors
- Not Available
- Affected organisms
- Not Available
Chemical Identifiers
- UNII
- 16VY3TM7ZO
- CAS number
- 91531-30-5
- InChI Key
- OQGRFQCUGLKSAV-JTQLQIEISA-N
- InChI
- InChI=1S/C13H14N2O3/c16-11-7-6-10(13(18)15-11)14-12(17)8-9-4-2-1-3-5-9/h1-5,10H,6-8H2,(H,14,17)(H,15,16,18)/t10-/m0/s1
- IUPAC Name
- N-[(3S)-2,6-dioxopiperidin-3-yl]-2-phenylacetamide
- SMILES
- O=C(CC1=CC=CC=C1)N[C@H]1CCC(=O)NC1=O
References
- General References
- Not Available
- External Links
- PubChem Compound
- 56260
- PubChem Substance
- 347828067
- ChemSpider
- 50771
- ChEMBL
- CHEMBL1980825
- ZINC
- ZINC000001590366
Clinical Trials
- Clinical Trials
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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 0.304 mg/mL ALOGPS logP 0.37 ALOGPS logP 0.13 Chemaxon logS -2.9 ALOGPS pKa (Strongest Acidic) 11.56 Chemaxon pKa (Strongest Basic) -2.4 Chemaxon Physiological Charge 0 Chemaxon Hydrogen Acceptor Count 3 Chemaxon Hydrogen Donor Count 2 Chemaxon Polar Surface Area 75.27 Å2 Chemaxon Rotatable Bond Count 3 Chemaxon Refractivity 64.2 m3·mol-1 Chemaxon Polarizability 24.89 Å3 Chemaxon Number of Rings 2 Chemaxon Bioavailability 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 splash10-002f-9320000000-345c6c112157d260c6fa Predicted MS/MS Spectrum - 10V, Positive (Annotated) Predicted LC-MS/MS splash10-002b-0790000000-d61ccca87f4ecca7bfaa Predicted MS/MS Spectrum - 10V, Negative (Annotated) Predicted LC-MS/MS splash10-004j-2960000000-9cc0f9402d52827a125f Predicted MS/MS Spectrum - 20V, Positive (Annotated) Predicted LC-MS/MS splash10-004l-5900000000-0c5e54e7e26f4e6300d9 Predicted MS/MS Spectrum - 20V, Negative (Annotated) Predicted LC-MS/MS splash10-004l-5900000000-107ab8b3c07e13f69c1e Predicted MS/MS Spectrum - 40V, Positive (Annotated) Predicted LC-MS/MS splash10-0006-9310000000-3051c7721ac1be562e67 Predicted MS/MS Spectrum - 40V, Negative (Annotated) Predicted LC-MS/MS splash10-0006-9300000000-b0d2f19dcf4cfc1f9bfe Predicted 1H NMR Spectrum 1D NMR Not Applicable Predicted 13C NMR Spectrum 1D NMR Not Applicable - Chromatographic Properties
Collision Cross Sections (CCS)
Adduct CCS Value (Å2) Source type Source [M-H]- 154.6368 predictedDeepCCS 1.0 (2019) [M+H]+ 157.0324 predictedDeepCCS 1.0 (2019) [M+Na]+ 162.94504 predictedDeepCCS 1.0 (2019)
Drug created at October 20, 2016 20:40 / Updated at July 18, 2023 22:56