{"id":"https://openalex.org/W4402397136","doi":"https://doi.org/10.1016/j.saa.2024.125114","title":"Synthesis and antibacterial evaluation of (5Z)-5-[(2-piperidinequinoline-3-yl)methyl]-2-chloroquinoline derivatives: Docking study on substituted N-alkylation and binding mechanisms with E. Coli PDF enzyme","display_name":"Synthesis and antibacterial evaluation of (5Z)-5-[(2-piperidinequinoline-3-yl)methyl]-2-chloroquinoline derivatives: Docking study on substituted N-alkylation and binding mechanisms with E. Coli PDF enzyme","publication_year":2024,"publication_date":"2024-09-10","ids":{"openalex":"https://openalex.org/W4402397136","doi":"https://doi.org/10.1016/j.saa.2024.125114","pmid":"https://pubmed.ncbi.nlm.nih.gov/39288604"},"language":"en","primary_location":{"id":"doi:10.1016/j.saa.2024.125114","doi":"https://doi.org/10.1016/j.saa.2024.125114","is_oa":false,"landing_page_url":"https://doi.org/10.1016/j.saa.2024.125114","pdf_url":null,"source":{"id":"https://openalex.org/S96873385","display_name":"Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy","issn_l":"1386-1425","issn":["1386-1425","1873-3557"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","dongbi-a","jufo-1","medline","norway-1","poland-140","russia-white-list-1","vabb-shw"],"host_organization":"https://openalex.org/P4310320990","host_organization_name":"Elsevier BV","host_organization_lineage":["https://openalex.org/P4310320990"],"host_organization_lineage_names":["Elsevier BV"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy","raw_type":"journal-article"},"volume":null,"type":"article","is_traditional":true,"indexed_in":["crossref","pubmed"],"open_access":{"is_oa":false,"oa_status":"closed","oa_url":null,"any_repository_has_fulltext":false},"authorships":[{"author_position":"first","author":{"id":"https://openalex.org/A5079313868","display_name":"Krunal V. Juddhawala","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I29563240","display_name":"Gujarat Technological University","ror":"https://ror.org/059x8vm09","country_code":"IN","type":"education","lineage":["https://openalex.org/I29563240"]}],"countries":["IN"],"is_corresponding":false,"raw_author_name":"K.V. Juddhawala","raw_affiliation_strings":["Gujarat Technological University, Near VGEC, Visat Gandhinagar Highway, Chandkheda, Ahmedabad, Gujarat 382424, India"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Gujarat Technological University, Near VGEC, Visat Gandhinagar Highway, Chandkheda, Ahmedabad, Gujarat 382424, India","institution_ids":["https://openalex.org/I29563240"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5076135990","display_name":"Nikhil M. Parekh","orcid":"https://orcid.org/0009-0008-1641-9267","observed_orcids":["https://orcid.org/0009-0008-1641-9267"]},"institutions":[],"countries":[],"is_corresponding":true,"raw_author_name":"Nikhil M Parekh","raw_affiliation_strings":["Department of Chemistry, SRICT Institute of Science & Research, UPL University of Sustainable Technology, Ankleshwar, India. Electronic address: nikhil.parekh@upluuniversity.ac.in"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Chemistry, SRICT Institute of Science & Research, UPL University of Sustainable Technology, Ankleshwar, India. Electronic address: nikhil.parekh@upluuniversity.ac.in","institution_ids":[]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5026670853","display_name":"Abdullah Mohammed Alswieleh","orcid":"https://orcid.org/0000-0001-8312-8330","observed_orcids":["https://orcid.org/0000-0001-8312-8330"]},"institutions":[{"id":"https://openalex.org/I28022161","display_name":"King Saud University","ror":"https://ror.org/02f81g417","country_code":"SA","type":"education","lineage":["https://openalex.org/I28022161"]}],"countries":["SA"],"is_corresponding":false,"raw_author_name":"Abdullah Alswieleh","raw_affiliation_strings":["Department of Chemistry, College of Science, King Saud University, P.O. Box 2455, Riyadh 11451, Saudi Arabia"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Chemistry, College of Science, King Saud University, P.O. Box 2455, Riyadh 11451, Saudi Arabia","institution_ids":["https://openalex.org/I28022161"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5013640220","display_name":"Karuppiah Nagaraj","orcid":"https://orcid.org/0000-0002-8927-6796","observed_orcids":["https://orcid.org/0000-0002-8927-6796"]},"institutions":[{"id":"https://openalex.org/I65220239","display_name":"Karpagam Academy of Higher Education","ror":"https://ror.org/00ssvzv66","country_code":"IN","type":"education","lineage":["https://openalex.org/I65220239"]}],"countries":["IN"],"is_corresponding":true,"raw_author_name":"Karuppiah Nagaraj","raw_affiliation_strings":["Department of Chemistry, Faculty of Engineering, Karpagam Academy of Higher Education, Coimbatore 641021, Tamilnadu, India. Electronic address: surfactantnagaraj@gmail.com"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Department of Chemistry, Faculty of Engineering, Karpagam Academy of Higher Education, Coimbatore 641021, Tamilnadu, India. Electronic address: surfactantnagaraj@gmail.com","institution_ids":["https://openalex.org/I65220239"]}]}],"institutions":[],"countries_distinct_count":2,"institutions_distinct_count":3,"corresponding_author_ids":["https://openalex.org/A5013640220","https://openalex.org/A5076135990"],"corresponding_institution_ids":["https://openalex.org/I65220239"],"apc_list":{"value":3470,"currency":"USD","value_usd":3470},"apc_paid":null,"fwci":0.6871,"has_fulltext":false,"cited_by_count":5,"citation_normalized_percentile":{"value":0.55339762,"is_in_top_1_percent":false,"is_in_top_10_percent":false},"cited_by_percentile_year":{"min":97,"max":98},"biblio":{"volume":"325","issue":null,"first_page":"125114","last_page":"125114"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T13160","display_name":"Synthesis and Biological Evaluation","score":0.4171999990940094,"subfield":{"id":"https://openalex.org/subfields/1605","display_name":"Organic Chemistry"},"field":{"id":"https://openalex.org/fields/16","display_name":"Chemistry"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},"topics":[{"id":"https://openalex.org/T13160","display_name":"Synthesis and Biological Evaluation","score":0.4171999990940094,"subfield":{"id":"https://openalex.org/subfields/1605","display_name":"Organic Chemistry"},"field":{"id":"https://openalex.org/fields/16","display_name":"Chemistry"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T10274","display_name":"Heterocyclic Compound Synthesis and Bioactivity","score":0.3237000107765198,"subfield":{"id":"https://openalex.org/subfields/1605","display_name":"Organic Chemistry"},"field":{"id":"https://openalex.org/fields/16","display_name":"Chemistry"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T14099","display_name":"Synthesis and Characterization of Heterocyclic Compounds","score":0.20409999787807465,"subfield":{"id":"https://openalex.org/subfields/1605","display_name":"Organic Chemistry"},"field":{"id":"https://openalex.org/fields/16","display_name":"Chemistry"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/2-4-thiazolidinediones","display_name":"2,4-thiazolidinediones","score":0.9419999718666077},{"id":"https://openalex.org/keywords/n-alkylation","display_name":"N-alkylation","score":0.8640000224113464},{"id":"https://openalex.org/keywords/antibacterial-activity","display_name":"antibacterial activity","score":0.6060000061988831},{"id":"https://openalex.org/keywords/bacillus-subtilis","display_name":"Bacillus subtilis","score":0.8769999742507935},{"id":"https://openalex.org/keywords/molecular-docking","display_name":"molecular docking","score":0.7670000195503235},{"id":"https://openalex.org/keywords/binding-mechanism","display_name":"binding mechanism","score":0.8370000123977661}],"concepts":[{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.9665607810020447},{"id":"https://openalex.org/C164361826","wikidata":"https://www.wikidata.org/wiki/Q177604","display_name":"Alkylation","level":3,"score":0.8289300203323364},{"id":"https://openalex.org/C40875361","wikidata":"https://www.wikidata.org/wiki/Q2356542","display_name":"Reagent","level":2,"score":0.5841155052185059},{"id":"https://openalex.org/C171560689","wikidata":"https://www.wikidata.org/wiki/Q193086","display_name":"Halide","level":2,"score":0.5536443591117859},{"id":"https://openalex.org/C32891209","wikidata":"https://www.wikidata.org/wiki/Q483666","display_name":"Spectroscopy","level":2,"score":0.5237227082252502},{"id":"https://openalex.org/C66974803","wikidata":"https://www.wikidata.org/wiki/Q10359898","display_name":"Nuclear magnetic resonance spectroscopy","level":2,"score":0.4477248787879944},{"id":"https://openalex.org/C41685203","wikidata":"https://www.wikidata.org/wiki/Q1974042","display_name":"Docking (animal)","level":2,"score":0.4299049377441406},{"id":"https://openalex.org/C2776590680","wikidata":"https://www.wikidata.org/wiki/Q413761","display_name":"Thiazolidine","level":2,"score":0.4124770164489746},{"id":"https://openalex.org/C178790620","wikidata":"https://www.wikidata.org/wiki/Q11351","display_name":"Organic chemistry","level":1,"score":0.38208359479904175},{"id":"https://openalex.org/C21951064","wikidata":"https://www.wikidata.org/wiki/Q899212","display_name":"Combinatorial chemistry","level":1,"score":0.354708731174469},{"id":"https://openalex.org/C161790260","wikidata":"https://www.wikidata.org/wiki/Q82264","display_name":"Catalysis","level":2,"score":0.12264284491539001},{"id":"https://openalex.org/C121332964","wikidata":"https://www.wikidata.org/wiki/Q413","display_name":"Physics","level":0,"score":0.0},{"id":"https://openalex.org/C159110408","wikidata":"https://www.wikidata.org/wiki/Q121176","display_name":"Nursing","level":1,"score":0.0},{"id":"https://openalex.org/C62520636","wikidata":"https://www.wikidata.org/wiki/Q944","display_name":"Quantum mechanics","level":1,"score":0.0},{"id":"https://openalex.org/C71924100","wikidata":"https://www.wikidata.org/wiki/Q11190","display_name":"Medicine","level":0,"score":0.0}],"mesh":[{"descriptor_ui":"D000478","descriptor_name":"Alkylation","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D000900","descriptor_name":"Anti-Bacterial Agents","qualifier_ui":"Q000138","qualifier_name":"chemical synthesis","is_major_topic":true},{"descriptor_ui":"D000900","descriptor_name":"Anti-Bacterial Agents","qualifier_ui":"Q000494","qualifier_name":"pharmacology","is_major_topic":true},{"descriptor_ui":"D000900","descriptor_name":"Anti-Bacterial Agents","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":true},{"descriptor_ui":"D004926","descriptor_name":"Escherichia coli","qualifier_ui":"Q000187","qualifier_name":"drug effects","is_major_topic":true},{"descriptor_ui":"D008826","descriptor_name":"Microbial Sensitivity Tests","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true},{"descriptor_ui":"D011485","descriptor_name":"Protein Binding","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D011804","descriptor_name":"Quinolines","qualifier_ui":"Q000138","qualifier_name":"chemical synthesis","is_major_topic":false},{"descriptor_ui":"D011804","descriptor_name":"Quinolines","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D011804","descriptor_name":"Quinolines","qualifier_ui":"Q000494","qualifier_name":"pharmacology","is_major_topic":false},{"descriptor_ui":"D011804","descriptor_name":"Quinolines","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D017550","descriptor_name":"Spectroscopy, Fourier Transform Infrared","qualifier_ui":null,"qualifier_name":null,"is_major_topic":false},{"descriptor_ui":"D029968","descriptor_name":"Escherichia coli Proteins","qualifier_ui":"Q000037","qualifier_name":"antagonists & inhibitors","is_major_topic":false},{"descriptor_ui":"D029968","descriptor_name":"Escherichia coli Proteins","qualifier_ui":"Q000378","qualifier_name":"metabolism","is_major_topic":false},{"descriptor_ui":"D029968","descriptor_name":"Escherichia coli Proteins","qualifier_ui":"Q000737","qualifier_name":"chemistry","is_major_topic":false},{"descriptor_ui":"D062105","descriptor_name":"Molecular Docking Simulation","qualifier_ui":null,"qualifier_name":null,"is_major_topic":true}],"locations_count":2,"locations":[{"id":"doi:10.1016/j.saa.2024.125114","doi":"https://doi.org/10.1016/j.saa.2024.125114","is_oa":false,"landing_page_url":"https://doi.org/10.1016/j.saa.2024.125114","pdf_url":null,"source":{"id":"https://openalex.org/S96873385","display_name":"Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy","issn_l":"1386-1425","issn":["1386-1425","1873-3557"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","dongbi-a","jufo-1","medline","norway-1","poland-140","russia-white-list-1","vabb-shw"],"host_organization":"https://openalex.org/P4310320990","host_organization_name":"Elsevier BV","host_organization_lineage":["https://openalex.org/P4310320990"],"host_organization_lineage_names":["Elsevier BV"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy","raw_type":"journal-article"},{"id":"pmid:39288604","doi":null,"is_oa":false,"landing_page_url":"https://pubmed.ncbi.nlm.nih.gov/39288604","pdf_url":null,"source":{"id":"https://openalex.org/S4306525036","display_name":"PubMed","issn_l":null,"issn":null,"is_oa":false,"is_in_doaj":false,"is_core":false,"listed_in":[],"host_organization":"https://openalex.org/I1299303238","host_organization_name":"National Institutes of Health","host_organization_lineage":["https://openalex.org/I1299303238"],"host_organization_lineage_names":[],"type":"repository"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy","raw_type":"Journal Article"}],"best_oa_location":null,"sustainable_development_goals":[],"study_designs":[],"awards":[],"funders":[{"id":"https://openalex.org/F4320321145","display_name":"King Saud University","ror":"https://ror.org/02f81g417"}],"has_content":{"grobid_xml":false,"pdf":false},"content_urls":null,"referenced_works_count":33,"referenced_works":["https://openalex.org/W1599503941","https://openalex.org/W1930201572","https://openalex.org/W1969322259","https://openalex.org/W1974323091","https://openalex.org/W1976579774","https://openalex.org/W1992222403","https://openalex.org/W2000470970","https://openalex.org/W2001881588","https://openalex.org/W2005508351","https://openalex.org/W2009123676","https://openalex.org/W2010637581","https://openalex.org/W2010774685","https://openalex.org/W2016836444","https://openalex.org/W2040019233","https://openalex.org/W2050737616","https://openalex.org/W2051879959","https://openalex.org/W2055551410","https://openalex.org/W2075080580","https://openalex.org/W2085465903","https://openalex.org/W2113523019","https://openalex.org/W2166202172","https://openalex.org/W2175496126","https://openalex.org/W2523137055","https://openalex.org/W2606623907","https://openalex.org/W2772137532","https://openalex.org/W2950072069","https://openalex.org/W2951888945","https://openalex.org/W2953035314","https://openalex.org/W4206077151","https://openalex.org/W4214860477","https://openalex.org/W4233880233","https://openalex.org/W4243178087","https://openalex.org/W4246432754"],"related_works":["https://openalex.org/W4404726978","https://openalex.org/W2885324046","https://openalex.org/W4282824026","https://openalex.org/W4402763438","https://openalex.org/W4385066488","https://openalex.org/W4213038046","https://openalex.org/W3044142566","https://openalex.org/W4206129430","https://openalex.org/W3191270813","https://openalex.org/W7159841933"],"abstract_inverted_index":null,"counts_by_year":[{"year":2025,"cited_by_count":5}],"updated_date":"2026-11-04T10:54:05.112534","created_date":"2024-09-11T00:00:00"}