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

Acetylcholinesterase / chemistry Cholinesterase Inhibitors / chemistry Molecular Docking Simulation Molecular Structure Structure-Activity Relationship Thiadiazoles / chemistry
1,3,4-thiadiazole-drug ADMET parameters antioxidant activity drug-likeness mixed-type AChE inhibitors molecular docking pharmacokinetics synthesis

Journal

Molecules (Basel, Switzerland)
ISSN: 1420-3049
Titre abrégé: Molecules
Pays: Switzerland
ID NLM: 100964009

Informations de publication

Date de publication:
28 Feb 2019
Historique:
received: 01 01 2019
revised: 15 02 2019
accepted: 18 02 2019
entrez: 3 3 2019
pubmed: 3 3 2019
medline: 20 6 2019
Statut: epublish

Résumé

A small library of new drug-1,3,4-thiazidazole hybrid compounds (

Identifiants

DOI: 10.3390/molecules24050860 PMID: 30823444 PMC: PMC6429202
pubmed: 30823444
pii: molecules24050860
doi: 10.3390/molecules24050860
pmc: PMC6429202
pii:
doi:

Substances chimiques

Cholinesterase Inhibitors 0
Thiadiazoles 0
1,3,4-thiadiazole 14IAC3GH7G
Acetylcholinesterase EC 3.1.1.7

Types de publication

Journal Article

Langues

eng

Sous-ensembles de citation

IM

Références

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Auteurs

Rabail Ujan (R)

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

Aamer Saeed (A)

Department of Chemistry, Quaid-I-Azam University, Islamabad 45320, Pakistan. aamersaeed@yahoo.com.
ORCID: 0000-0002-7112-9296

Pervaiz Ali Channar (PA)

Department of Chemistry, Quaid-I-Azam University, Islamabad 45320, Pakistan. mrpervaiz@gmail.com.

Fayaz Ali Larik (FA)

Department of Chemistry, Quaid-I-Azam University, Islamabad 45320, Pakistan. fayazali@chem.qau.edu.pk.
ORCID: 0000-0002-8491-5229

Qamar Abbas (Q)

Department of Physiology, University of Sindh, Jamshoro 76080, Pakistan. qamar.abbas.qau@gmail.com.

Mohamed F Alajmi (MF)

Department of Pharmacognosy, College of Pharmacy, King Saud University, Riyadh 11451, Saudi Arabia. malajmii@ksu.edu.sa.

Hesham R El-Seedi (HR)

Pharmacognosy Group, Department of Medicinal Chemistry, Biomedical Center (BMC), Uppsala University, SE-751 23 Uppsala, Sweden. Hesham.El-Seedi@fkog.uu.se.

Mahboob Ali Rind (MA)

Dr. M.A. Kazi Institute of Chemistry, University of Sindh, Jamshoro 76080, Pakistan. mahboobalirind@gmail.com.

Mubashir Hassan (M)

Department of Biological Sciences, College of Natural Sciences, Kongju National University, 56 Gongjudehak-Ro, Gongju, Chungnam 314-701, Korea. mubashirhassan_gcul@yahoo.com.

Hussain Raza (H)

Department of Biological Sciences, College of Natural Sciences, Kongju National University, 56 Gongjudehak-Ro, Gongju, Chungnam 314-701, Korea. hussain_solangi@yahoo.com.
ORCID: 0000-0002-3078-6660

Sung-Yum Seo (SY)

Department of Biological Sciences, College of Natural Sciences, Kongju National University, 56 Gongjudehak-Ro, Gongju, Chungnam 314-701, Korea. dnalove@kongju.ac.kr.

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Classifications MeSH

questionsmedicales.fr › Enzymes et coenzymes › Enzymes › Hydrolases › Esterases › Carboxylic ester hydrolases › Cholinesterases › Acetylcholinesterase › Drug-1,3,4-Thiadiazole Conjugates as Novel...
questionsmedicales.fr › Actions chimiques et utilisations › Actions pharmacologiques › Effets physiologiques des médicaments › Agents neuromédiateurs › Agents cholinergiques › Anticholinestérasiques › Drug-1,3,4-Thiadiazole Conjugates as Novel...
questionsmedicales.fr › Sciences de l'information › Méthodologies informatiques › Simulation numérique › Simulation de docking moléculaire › Drug-1,3,4-Thiadiazole Conjugates as Novel...
questionsmedicales.fr › Phénomènes chimiques › Structure moléculaire › Drug-1,3,4-Thiadiazole Conjugates as Novel...
questionsmedicales.fr › Phénomènes physiologiques › Phénomènes pharmacologiques et toxicologiques › Phénomènes pharmacologiques › Relation structure-activité › Drug-1,3,4-Thiadiazole Conjugates as Novel...
questionsmedicales.fr › Composés hétérocycliques › Composés hétéromonocycliques › Azoles › Thiazoles › Thiadiazoles › Drug-1,3,4-Thiadiazole Conjugates as Novel...