Physical and bioactive properties of amide derivatives of L-isoleucine using theoretical calculation: drug-likeness, DFT and pharmacokinetics
Yazarlar (3)
Prof. Dr. Ramazan ERENLER Tokat Gaziosmanpaşa Üniversitesi, Türkiye
B. Dag Batman University, Türkiye
B. B. Ozbek Tokat Gaziosmanpaşa Üniversitesi, Türkiye
| Makale Türü |
Özgün Makale
(SCOPUS dergilerinde yayınlanan tam makale)
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| Dergi Adı | Unec Journal of Engineering and Applied Sciences | ||
| Dergi ISSN | 2790-234X Dergi Bilgileri (2022) | ||
| Dergi Tarandığı Indeksler | Scopus | ||
| Makale Dili | Türkçe | Basım Tarihi | 01-2022 |
| Cilt / Sayı / Sayfa | 2 / 1 / 26–32 | DOI | – |
| Makale Linki | https://unec-jeas.com/storage/pages/217/4r-erenler-et-al-26-32.pdf | ||
| UAK Araştırma Alanları |
Organik Kimya
Spektroskopi
Nanoteknoloji
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| Özet |
| The chiral compounds bearing the nitrogen atom have been used in pharmaceutical industry for drug development. Computational study of amide derivatives were performed using B3LYP/6-31G+(d, p) level in the gas phase to determine their potential to be drugs. The corresponding molecules were determined as MEP map and HOMO-LUMO energy. Druglikeness of all molecules were examined theoretically. |
| Anahtar Kelimeler |
| amides | DFT | druglikeness | N-boc-deprotection | synthesis |
