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Drug-1,3,4-Thiadiazole Conjugates as Novel Mixed-Type Inhibitors of Acetylcholinesterase: Synthesis, Molecular Docking, Pharmacokinetics, and ADMET Evaluation.

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第一作者： Rabail,Ujan

第一单位： Dr. M.A. Kazi Institute of Chemistry, University of Sindh, Jamshoro 76080, Pakistan. rabailrabailnoor@gmail.com.

作者： Rabail,Ujan ^[1] ; Aamer,Saeed ^[2] ; Pervaiz Ali,Channar ^[3] ; Fayaz Ali,Larik ^[4] ; Qamar,Abbas ^[5] ; Mohamed F,Alajmi ^[6] ; Hesham R,El-Seedi ^[7] ; Mahboob Ali,Rind ^[8] ; Mubashir,Hassan ^[9] ; Hussain,Raza ^[10] ; Sung-Yum,Seo ^[11]

作者单位： Dr. M.A. Kazi Institute of Chemistry, University of Sindh, Jamshoro 76080, Pakistan. rabailrabailnoor@gmail.com. ^[1] Department of Chemistry, Quaid-I-Azam University, Islamabad 45320, Pakistan. aamersaeed@yahoo.com. ^[2] Department of Chemistry, Quaid-I-Azam University, Islamabad 45320, Pakistan. mrpervaiz@gmail.com. ^[3] Department of Chemistry, Quaid-I-Azam University, Islamabad 45320, Pakistan. fayazali@chem.qau.edu.pk. ^[4] Department of Physiology, University of Sindh, Jamshoro 76080, Pakistan. qamar.abbas.qau@gmail.com. ^[5] Department of Pharmacognosy, College of Pharmacy, King Saud University, Riyadh 11451, Saudi Arabia. malajmii@ksu.edu.sa. ^[6] Pharmacognosy Group, Department of Medicinal Chemistry, Biomedical Center (BMC), Uppsala University, SE-751 23 Uppsala, Sweden. Hesham.El-Seedi@fkog.uu.se. ^[7] Dr. M.A. Kazi Institute of Chemistry, University of Sindh, Jamshoro 76080, Pakistan. mahboobalirind@gmail.com. ^[8] Department of Biological Sciences, College of Natural Sciences, Kongju National University, 56 Gongjudehak-Ro, Gongju, Chungnam 314-701, Korea. mubashirhassan_gcul@yahoo.com. ^[9] Department of Biological Sciences, College of Natural Sciences, Kongju National University, 56 Gongjudehak-Ro, Gongju, Chungnam 314-701, Korea. hussain_solangi@yahoo.com. ^[10] Department of Biological Sciences, College of Natural Sciences, Kongju National University, 56 Gongjudehak-Ro, Gongju, Chungnam 314-701, Korea. dnalove@kongju.ac.kr. ^[11]

关键词 1,3,4-thiadiazole-drug ADMET parameters antioxidant activity drug-likeness mixed-type AChE inhibitors molecular docking pharmacokinetics synthesis

医学主题词乙酰胆碱酯酶(Acetylcholinesterase);胆碱酯酶抑制剂(Cholinesterase Inhibitors);分子结构(Molecular Structure);构效关系(Structure-Activity Relationship);噻二唑类(Thiadiazoles)

DOI 10.3390/molecules24050860

PMID 30823444

发布时间 2020-02-25

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