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Part 1: Document Description
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Citation |
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Title: |
Replication Data for: A concise SAR-analysis of antimicrobial cationic amphipathic barbiturates for an improved activity-toxicity profile |
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Identification Number: |
doi:10.18710/GNTWOG |
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Distributor: |
DataverseNO |
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Date of Distribution: |
2022-07-13 |
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Version: |
2 |
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Bibliographic Citation: |
Langer, Manuel Karl; Zilioli, Francesco; Bayer, Annette, 2022, "Replication Data for: A concise SAR-analysis of antimicrobial cationic amphipathic barbiturates for an improved activity-toxicity profile", https://doi.org/10.18710/GNTWOG, DataverseNO, V2 |
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Citation |
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Title: |
Replication Data for: A concise SAR-analysis of antimicrobial cationic amphipathic barbiturates for an improved activity-toxicity profile |
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Identification Number: |
doi:10.18710/GNTWOG |
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Authoring Entity: |
Langer, Manuel Karl (UiT The Arctic University of Norway) |
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Zilioli, Francesco (UiT The Arctic University of Norway) |
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Bayer, Annette (UiT The Arctic University of Norway) |
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Other identifications and acknowledgements: |
Johansen, Jostein |
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Other identifications and acknowledgements: |
Bayer, Annette |
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Producer: |
UiT The Arctic University of Norway |
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Date of Production: |
2022-04-30 |
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Software used in Production: |
MassLynx |
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Software used in Production: |
LTQ Tune Plus |
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Software used in Production: |
Qual Browser Thermo Xcalibur |
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Software used in Production: |
Icon NMR for TopSpin 3.2 |
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Grant Number: |
AntifoMar |
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Grant Number: |
LeadScAMR |
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Distributor: |
DataverseNO |
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Distributor: |
UiT The Arctic University of Norway |
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Access Authority: |
Langer, Manuel Karl |
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Depositor: |
Langer, Manuel K |
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Date of Deposit: |
2022-05-16 |
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Holdings Information: |
https://doi.org/10.18710/GNTWOG |
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Study Scope |
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Keywords: |
Chemistry, Medicine, Health and Life Sciences, Antimicrobial peptides (AMPs), Amphipathic, Tetrasubstituted Barbiturates, Small mimics of antimicrobial peptides (SMAMPs), Nuclear magnetic resonance (NMR), High resolution mass spectrometry (HRMS), Infrafred spectroscopy (IR), Supercritical fluid chromatography (SFC) |
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Abstract: |
<p>This dataset contains the analytical data of 58 amphipathic, tetrasubstituted barbituric acid derivatives and their synthetic intermediates. The analytical data includes NMR raw data and HRMS, IR and SFC data as PDF files.</p> <p>The barbituric acid derivatives were constructed to be mimics of antimicrobial peptides (AMPs) and were tested for their antimicrobial activity in the study "A concise SAR-analysis of antimicrobial cationic amphipathic barbiturates for an improved activity-toxicity profile". The structure of all compounds can be found in the data files.</p> |
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Date of Collection: |
2018-07-01-2021-08-03 |
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Kind of Data: |
Experimental Data |
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Methodology and Processing |
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Sources Statement |
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Data Access |
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Notes: |
The data is part of manuscript send for review. The editor and reviewers can contact the contactperson specified in the ReadMe file for access. When the manuscript is accepted the data is to become unrestricted. |
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Other Study Description Materials |
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Related Publications |
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Citation |
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Title: |
M.K. Langer, A. Rahman, H. Dey, T. Anderssen, F. Zilioli, T. Haug, H.-M. Blencke, K. Stensvåg, M.B. Strøm, A. Bayer, A concise SAR-analysis of antimicrobial cationic amphipathic barbiturates for an improved activity-toxicity profile, Eur. J. Med. Chem., 241 (2022) 114632. https://doi.org/10.1016/j.ejmech.2022.114632 |
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Bibliographic Citation: |
M.K. Langer, A. Rahman, H. Dey, T. Anderssen, F. Zilioli, T. Haug, H.-M. Blencke, K. Stensvåg, M.B. Strøm, A. Bayer, A concise SAR-analysis of antimicrobial cationic amphipathic barbiturates for an improved activity-toxicity profile, Eur. J. Med. Chem., 241 (2022) 114632. https://doi.org/10.1016/j.ejmech.2022.114632 |
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Label: |
00_README.txt |
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Notes: |
text/plain |
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Label: |
01_Chemical_structures_all.pdf |
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Notes: |
application/pdf |
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Label: |
02_Analytical_data_overview.pdf |
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Notes: |
application/pdf |
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Label: |
03_Analytical_data_overview.csv |
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Notes: |
text/comma-separated-values |
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Label: |
04_SMILES_all_compounds.csv |
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Notes: |
text/csv |
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Label: |
05_file_tree.txt |
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Notes: |
text/plain |
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Label: |
raw_data.zip |
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Notes: |
application/zip |