X-ray Structures and Computational Studies of Two Bioactive 2-(Adamantane-1-carbonyl)-<i>N</i>-substituted Hydrazine-1-carbothioamides.

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作者： Lamya H,Al-Wahaibi ^[1] ; Kowsalya,Alagappan ^[2] ; Olivier,Blacque ^[3] ; Ahmed A B,Mohamed ^[4] ; Hanan M,Hassan ^[5] ; María Judith,Percino ^[6] ; Ali A,El-Emam ^[4] ; Subbiah,Thamotharan ^[2]

作者单位： Department of Chemistry, College of Sciences, Princess Nourah Bint Abdulrahman University, Riyadh 11671, Saudi Arabia. ^[1] Biomolecular Crystallography Laboratory, Department of Bioinformatics, School of Chemical and Biotechnology, SASTRA Deemed University, Thanjavur 613 401, India. ^[2] Department of Chemistry, University of Zurich, Winterthurerstrasse 190, 8057 Zurich, Switzerland. ^[3] Department of Medicinal Chemistry, Faculty of Pharmacy, Mansoura University, Mansoura 35516, Egypt. ^[4] Department of Pharmacology and Biochemistry, Faculty of Pharmacy, Delta University for Science and Technology, International Costal Road, Gamasa City, Mansoura 11152, Egypt. ^[5] Unidad de Polímeros y Electrónica Orgánica, Instituto de Ciencias, Benemérita Universidad Autónoma de Puebla, Val3-Ecocampus Valsequillo, Independencia O2 Sur 50, San Pedro Zacachimalpa, Puebla 72960, Mexico. ^[6]

关键词 CLP–Pixel H-H bonding Hirshfeld surface QTAIM adamantane antiproliferative agents hydrazine-1-carbothioamide molecular docking urease inhibition

主题词氢键合(Hydrogen Bonding);金刚烷(Adamantane);结晶学, X线(Crystallography, X-Ray);X线(X-Rays);尿素酶(Urease)

DOI 10.3390/molecules27238425

PMID 36500517

发布时间 2022-12-21

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