Novel palladium (II) complexes with iminocoumarin ligands: Synthesis, characterisation, electrochemical behaviour, DFT calculations and biological activities, ADMET study and molecular docking

Synthesis, characterization, molecular docking and in vitro screening of new metal complexes with coumarin Schiff base as anticholine esterase and antipancreatic cholesterol esterase agents

(2021) Ömer Şahin et al.   JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS

Selectivity control in the reaction between 2-hydroxyarylaldehydes and 4-hydroxycoumarin. Antioxidant activities and computational studies of the formed products

(2021) Kamilia Ould Lamara et al.   JOURNAL OF MOLECULAR STRUCTURE

Synthesis, spectroscopic characterization, biological activity, DFT and molecular docking study of novel 4-hydroxycoumarine derivatives and corresponding palladium(II) complexes

(2020) Edina H. Avdović et al.   INORGANICA CHIMICA ACTA

Pharmacophore development, drug-likeness analysis, molecular docking, and molecular dynamics simulations for identification of new CK2 inhibitors

(2020) Sara Hammad et al.   JOURNAL OF MOLECULAR MODELING

Synthesis, characterization and biological activity of nano-sized Co(II), Ni(II), Cu(II), Pd(II) and Ru(III) complexes of tetradentate hydrazone ligand

(2020) Fatma I. Abouzayed et al.   JOURNAL OF MOLECULAR STRUCTURE

DFT calculations on molecular structures, HOMO-LUMO study, reactivity descriptors and spectral analyses of newly synthesized diorganotin(IV) 2-chloridophenylacetohydroxamate complexes

(2019) VineetKumar Choudhary et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Crystal structures and DFT analysis of Palladium(II) complexes with Schiff bases derived from N,N-dialkyl-p-phenylenediamines

(2019) Luís Eduardo Sarto et al.   JOURNAL OF MOLECULAR STRUCTURE

New complexes of manganese (II) and copper (II) derived from the two new furopyran-3, 4-dione ligands: Synthesis, spectral characterization, ESR, DFT studies and evaluation of antimicrobial activity

(2019) Yamina Abdi et al.   JOURNAL OF MOLECULAR STRUCTURE

Pd (II) complexes of bidentate chalcone ligands: Synthesis, spectral, thermal, antitumor, antioxidant, antimicrobial, DFT and SAR studies

(2018) Mohamed Gaber et al.   JOURNAL OF MOLECULAR STRUCTURE

Synthesis and characterization of new complexes of nickel (II), palladium (II) and platinum(II) with derived sulfonamide ligand: Structure, DFT study, antibacterial and cytotoxicity activities

(2018) Afaf Bouchoucha et al.   JOURNAL OF MOLECULAR STRUCTURE

admetSAR 2.0: web-service for prediction and optimization of chemical ADMET properties

(2018) Hongbin Yang et al.   BIOINFORMATICS

Synthesis, characterisation, estimation of ground-and excited-state dipole moments using solvatochromic shift and theoretical studies of new iminocoumarin derivatives

(2018) Amal Rabahi et al.   JOURNAL OF MOLECULAR STRUCTURE

Synthesis, characterization and cytotoxicity of a new palladium(II) complex with a coumarin-derived ligand 3-(1-(3-hydroxypropylamino)ethylidene)chroman-2,4-dione. Crystal structure of the 3-(1-(3-hydroxypropylamino)ethylidene)-chroman-2,4-dione

(2017) Edina H. Avdović et al.   INORGANICA CHIMICA ACTA

Synthesis, structural analysis, redox properties and in vitro antitumor evaluation of half-sandwich complexes of Ru(II) with aminocoumarins

(2017) Anna Skoczynska et al.   POLYHEDRON

Synthesis, characterization, X-ray crystal structures and antibacterial activities of Schiff base ligands derived from allylamine and their vanadium(IV), cobalt(III), nickel(II), copper(II), zinc(II) and palladium(II) complexes

(2016) Hadi Amiri Rudbari et al.   JOURNAL OF MOLECULAR STRUCTURE

Structure, vibrational analysis, electronic properties and chemical reactivity of two benzoxazole derivatives: Functional density theory study

(2016) Sihem Zaater et al.   JOURNAL OF MOLECULAR STRUCTURE

Synthesis, structure, DFT calculations, electrochemistry, fluorescence, DNA binding and molecular docking aspects of a novel oxime based ligand and its palladium(II) complex

(2016) Nirmalya Bandyopadhyay et al.   JOURNAL OF PHOTOCHEMISTRY AND PHOTOBIOLOGY B-BIOLOGY

Novel synthesis of 2-imino-2H-chromene-3-carboximide metal complexes

(2015) Madiha H. Soliman et al.   JOURNAL OF THERMAL ANALYSIS AND CALORIMETRY

Synthesis, spectroscopic, anticancer, antibacterial and antifungal studies of Ni(II) and Cu(II) complexes with hydrazine carboxamide, 2-[3-methyl-2-thienyl methylene]

(2015) Sulekh Chandra et al.   SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY

New complexes of manganese (II), nickel (II) and copper (II) with derived benzoxazole ligands: Synthesis, characterization, DFT, antimicrobial activity, acute and subacute toxicity

(2014) Afaf Bouchoucha et al.   INORGANICA CHIMICA ACTA

Synthesis and optical properties of coumarins and iminocoumarins: Estimation of ground- and excited-state dipole moments from a solvatochromic shift and theoretical methods

(2014) Amal Rabahi et al.   JOURNAL OF MOLECULAR LIQUIDS

Synthesis, characterization, electrochemical studies and DFT calculations of amino acids ternary complexes of copper (II) with isonitrosoacetophenone. Biological activities

(2014) Nabila Tidjani-Rahmouni et al.   JOURNAL OF MOLECULAR STRUCTURE

Cytotoxicity, antioxidant and glutathione S-transferase inhibitory activity of palladium(II) chloride complexes bearing nucleobase ligands

(2014) Samuel Tetteh et al.   TRANSITION METAL CHEMISTRY

New nickel(II), palladium(II), platinum(II) complexes with aromatic methanesulfonylhydrazone based ligands. Synthesis, spectroscopic characterization and in vitro antibacterial evaluation

(2013) Ümmühan Ö. Özdemir et al.   INORGANICA CHIMICA ACTA

Iron and nickel complexes with heterocyclic ligands: Stability, synthesis, spectral characterization, antimicrobial activity, acute and subacute toxicity

(2013) Afaf Bouchoucha et al.   JOURNAL OF TRACE ELEMENTS IN MEDICINE AND BIOLOGY

Synthesis, spectroscopic and radical scavenging studies of palladium(II)-hydrazide complexes

(2013) Qurrat Ul Ain et al.   SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY

Synthesis and characterization of 1,2-bis(2-(5-bromo-2-hydroxybenzilidenamino)-4-chlorophenoxy)ethane and its metal complexes: An experimental, theoretical, electrochemical, antioxidant and antibacterial study

(2013) Salih Ilhan et al.   SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY

Review on Natural Coumarin Lead Compounds for Their Pharmacological Activity

(2013) K. N. Venugopala et al.   Biomed Research International

In Vivo Validation of Thymidylate Kinase (TMK) with a Rationally Designed, Selective Antibacterial Compound

(2012) Thomas A. Keating et al.   ACS Chemical Biology

Synthesis, characterization and cytotoxicity of gold(III) complexes with deprotonated pyridyl carboxamide

(2012) Shuxiang Wang et al.   APPLIED ORGANOMETALLIC CHEMISTRY

Synthesis, characterization, crystal structure and theoretical approach of Cu(II) complex with 4-{(Z)-[(2-hydroxybenzoyl)hydrazono]methyl}benzoic acid

(2012) Shi-Liang Chen et al.   JOURNAL OF MOLECULAR STRUCTURE

Ruthenium(II) carbonyl complexes containing pyridine carboxamide ligands and PPh3/AsPh3/Py coligands: Synthesis, spectral characterization, catalytic and antioxidant studies

(2012) Rangasamy Ramachandran et al.   SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY

SYNTHESIS, CHARACTERIZATION AND ANTIOXIDANT ACTIVITY OF SOME TRANSITION METAL COMPLEXES WITH TERPENOID DERIVATIVES

(2012) ALKA CHOUDHARY et al.   JOURNAL OF THE CHILEAN CHEMICAL SOCIETY

Pd(ii) and Ni(ii) complexes featuring a “phosphasalen” ligand: synthesis and DFT study

(2011) Thi-Phuong-Anh Cao et al.   DALTON TRANSACTIONS

Novel palladium(II) and platinum(II) complexes with 1H-benzimidazol-2-ylmethyl-N-(4-bromo-phenyl)-amine: Structural studies and anticancer activity

(2011) Nour T. Abdel Ghani et al.   EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY

Studies on the effect of metal ions of hydrazone complexes on interaction with nucleic acids, bovine serum albumin and antioxidant properties

(2011) Palanisamy Sathyadevi et al.   INORGANICA CHIMICA ACTA

Synthesis, characterization, and antibacterial activity of the ligands including thiophene/furan ring systems and their Cu(II), Zn(II) complexes

(2011) Ayla Balaban Gündüzalp et al.   MEDICINAL CHEMISTRY RESEARCH

Molecular structure and spectroscopic studies on novel complexes of coumarin-3-carboxylic acid with Ni(II), Co(II), Zn(II) and Mn(II) ions based on density functional theory

(2011) B.S. Creaven et al.   SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY

Synthesis, characterization and antimicrobial activity of 3,5-di-tert-butylsalicylaldehyde-S-methylthiosemicarbazones and their Ni(II) complexes

(2011) Baki Türkkan et al.   TRANSITION METAL CHEMISTRY

Transition metal complexes with N, S donor ligands as synthetic antioxidants: Synthesis, characterization and antioxidant activity

(2010) Alka Choudhary et al.   JOURNAL OF ENZYME INHIBITION AND MEDICINAL CHEMISTRY

Modeling the binding modes of stilbene analogs to cyclooxygenase-2: a molecular docking study

(2010) Souhila Bouaziz-Terrachet et al.   JOURNAL OF MOLECULAR MODELING

Synthesis and study of physico-chemical properties of a new chiral Schiff base ligand and its metal complex

(2008) Gopa Barman Roy   INORGANICA CHIMICA ACTA

Rational Enhancement of Second-Order Nonlinearity: Bis-(4-methoxyphenyl)hetero-aryl-amino Donor-Based Chromophores: Design, Synthesis, and Electrooptic Activity

(2008) Joshua A. Davies et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY