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Pregled bibliografske jedinice broj: 748756

Zbornik radova

Autori: Mišetić, Petra; Ilijaš, Marina; Koštrun, Sanja; Gabelica Marković, Vesna
Naslov: High throughput lipophilicity determination of novel macrolide inspired macrocycles
( High throughput lipophilicity determination of novel macrolide inspired macrocycles )
Izvornik:
Skup: XXIII International Symposium on Medicinal Chemistry
Mjesto i datum: Lisabon, Portugal, 7-11.09.2014.
Ključne riječi: Makrocikli; makrolidi; lipofilnost
( Macrocycles; macrolides; lipophilicity )
Sažetak:
Currently, there is a large interest in macrocycles due to their structural uniqueness and high potential for difficult targets. In order to preserve favourable ADME properties of novel macrocyclic compounds, high-throughput chromatographic determination of lipophilicity and permeability parameters was used to monitor PhysChem properties. Standard computational tools for lipophilicity prediction are not applicable for 3D enriched macrocyclic compounds, therefore measured PhysChem data were used to guide design of novel compounds. Chromatographic Hydrophobicity Index by gradient reverse-phase HPLC was used at different pH values. An LC-MS system was used due to significant number of compounds lacking chromophores. The advantage of high-throughput PhysChem determination is the small amount of sample needed, which is favourable for the early stage of drug discovery.
Vrsta sudjelovanja: Poster
Vrsta prezentacije u zborniku: Sažetak
Vrsta recenzije: Nema recenziju
Izvorni jezik: eng
Kategorija: Znanstveni
Znanstvena područja:
Kemija
Upisao u CROSBI: Vesna Gabelica Markovic (Vesna.GabelicaMarkovic@glpg.com), 21. Sij. 2015. u 15:02 sati



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