Cargando…
RP-18 TLC Chromatographic and Computational Study of Skin Permeability of Steroids
The skin permeability of steroids, as investigated in this study, is important because some of these compounds are, or could, be used in preparations applied topically. Several models of skin permeability, involving thin layer chromatographic and calculated descriptors, were generated and validated...
Autores principales: | , , |
---|---|
Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
MDPI
2021
|
Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8308496/ https://www.ncbi.nlm.nih.gov/pubmed/34206570 http://dx.doi.org/10.3390/ph14070600 |
_version_ | 1783728295023476736 |
---|---|
author | Sobanska, Anna W. Weronika Robertson, Jeremy Brzezińska, Elżbieta |
author_facet | Sobanska, Anna W. Weronika Robertson, Jeremy Brzezińska, Elżbieta |
author_sort | Sobanska, Anna W. Weronika |
collection | PubMed |
description | The skin permeability of steroids, as investigated in this study, is important because some of these compounds are, or could, be used in preparations applied topically. Several models of skin permeability, involving thin layer chromatographic and calculated descriptors, were generated and validated using K(p) reference values obtained in silico and then tested on a group of solutes whose experimental K(p) values could be found (log K(p)(exp)). The study established that the most applicable log K(p) model is based on RP-18 thin layer chromatographic data (R(M)) and the calculated descriptors V(M) (molar volume) and PSA (polar surface area). Two less efficient, yet simple, equations based on PSA or V(M) combined with HD (H-donor count) can be used with caution for rapid, rough estimations of compounds’ skin permeability prior to their chemical synthesis. |
format | Online Article Text |
id | pubmed-8308496 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2021 |
publisher | MDPI |
record_format | MEDLINE/PubMed |
spelling | pubmed-83084962021-07-25 RP-18 TLC Chromatographic and Computational Study of Skin Permeability of Steroids Sobanska, Anna W. Weronika Robertson, Jeremy Brzezińska, Elżbieta Pharmaceuticals (Basel) Article The skin permeability of steroids, as investigated in this study, is important because some of these compounds are, or could, be used in preparations applied topically. Several models of skin permeability, involving thin layer chromatographic and calculated descriptors, were generated and validated using K(p) reference values obtained in silico and then tested on a group of solutes whose experimental K(p) values could be found (log K(p)(exp)). The study established that the most applicable log K(p) model is based on RP-18 thin layer chromatographic data (R(M)) and the calculated descriptors V(M) (molar volume) and PSA (polar surface area). Two less efficient, yet simple, equations based on PSA or V(M) combined with HD (H-donor count) can be used with caution for rapid, rough estimations of compounds’ skin permeability prior to their chemical synthesis. MDPI 2021-06-22 /pmc/articles/PMC8308496/ /pubmed/34206570 http://dx.doi.org/10.3390/ph14070600 Text en © 2021 by the authors. https://creativecommons.org/licenses/by/4.0/Licensee MDPI, Basel, Switzerland. This article is an open access article distributed under the terms and conditions of the Creative Commons Attribution (CC BY) license (https://creativecommons.org/licenses/by/4.0/). |
spellingShingle | Article Sobanska, Anna W. Weronika Robertson, Jeremy Brzezińska, Elżbieta RP-18 TLC Chromatographic and Computational Study of Skin Permeability of Steroids |
title | RP-18 TLC Chromatographic and Computational Study of Skin Permeability of Steroids |
title_full | RP-18 TLC Chromatographic and Computational Study of Skin Permeability of Steroids |
title_fullStr | RP-18 TLC Chromatographic and Computational Study of Skin Permeability of Steroids |
title_full_unstemmed | RP-18 TLC Chromatographic and Computational Study of Skin Permeability of Steroids |
title_short | RP-18 TLC Chromatographic and Computational Study of Skin Permeability of Steroids |
title_sort | rp-18 tlc chromatographic and computational study of skin permeability of steroids |
topic | Article |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8308496/ https://www.ncbi.nlm.nih.gov/pubmed/34206570 http://dx.doi.org/10.3390/ph14070600 |
work_keys_str_mv | AT sobanskaannawweronika rp18tlcchromatographicandcomputationalstudyofskinpermeabilityofsteroids AT robertsonjeremy rp18tlcchromatographicandcomputationalstudyofskinpermeabilityofsteroids AT brzezinskaelzbieta rp18tlcchromatographicandcomputationalstudyofskinpermeabilityofsteroids |