Works matching DE "LIPOPHILICITY"

Results: 939

Descriptors for High‐Energy Nitro Compounds; Estimation of Thermodynamic, Physicochemical and Environmental Properties.

Published in:

Propellants, Explosives, Pyrotechnics, 2021, v. 46, n. 2, p. 267, doi. 10.1002/prep.202000117

By:

Abraham, Michael H.;
Acree, William E.;
Liu, Xiangli

Publication type:

Article

Compatibility studies with pharmaceutical excipients for aripiprazole–heptakis (2,6-di-O-methyl)-β-cyclodextrin supramolecular adduct.

Published in:

Journal of Thermal Analysis & Calorimetry, 2020, v. 142, n. 5, p. 1963, doi. 10.1007/s10973-020-09901-7

By:

Tănase, Ionuț-Mihai;
Sbârcea, Laura;
Ledeţi, Adriana;
Barvinschi, Paul;
Cîrcioban, Denisa;
Vlase, Gabriela;
Văruţ, Renata-Maria;
Ledeţi, Ionuţ

Publication type:

Article

Quantum Computational Investigation of (E)-1-(4-methoxyphenyl)-5-methyl- N ′-(3-phenoxybenzylidene)-1 H -1,2,3-triazole-4-carbohydrazide.

Published in:

Molecules, 2022, v. 27, n. 7, p. 2193, doi. 10.3390/molecules27072193

By:

Gökce, Halil;
Şen, Fatih;
Sert, Yusuf;
Abdel-Wahab, Bakr F.;
Kariuki, Benson M.;
El-Hiti, Gamal A.

Publication type:

Article

Lipophilicity and Pharmacokinetic Properties of New Anticancer Dipyridothiazine with 1,2,3-Triazole Substituents.

Published in:

Molecules, 2022, v. 27, n. 4, p. 1253, doi. 10.3390/molecules27041253

By:

Morak-Młodawska, Beata;
Jeleń, Małgorzata

Publication type:

Article

A Comparative Study of the Lipophilicity of Metformin and Phenformin.

Published in:

Molecules, 2021, v. 26, n. 21, p. 6613, doi. 10.3390/molecules26216613

By:

Dołowy, Małgorzata;
Jampilek, Josef;
Bober-Majnusz, Katarzyna

Publication type:

Article

Improved Lipophilicity and Aqueous Solubility Prediction with Composite Graph Neural Networks.

Published in:

Molecules, 2021, v. 26, n. 20, p. 6185, doi. 10.3390/molecules26206185

By:

Wieder, Oliver;
Kuenemann, Mélaine;
Wieder, Marcus;
Seidel, Thomas;
Meyer, Christophe;
Bryant, Sharon D.;
Langer, Thierry

Publication type:

Article

Selected Drug-Likeness Properties of 2-Arylidene-indan-1,3-dione Derivatives—Chemical Compounds with Potential Anti-Cancer Activity.

Published in:

Molecules, 2021, v. 26, n. 17, p. 5256, doi. 10.3390/molecules26175256

By:

Pluskota, Robert;
Jaroch, Karol;
Kośliński, Piotr;
Ziomkowska, Blanka;
Lewińska, Agnieszka;
Kruszewski, Stefan;
Bojko, Barbara;
Koba, Marcin

Publication type:

Article

Diversity of the Chemical Profile and Biological Activity of Capsicum annuum L. Extracts in Relation to Their Lipophilicity.

Published in:

Molecules, 2021, v. 26, n. 17, p. 5215, doi. 10.3390/molecules26175215

By:

Chilczuk, Barbara;
Marciniak, Beata;
Kontek, Renata;
Materska, Małgorzata

Publication type:

Article

Photosynthesis-Inhibiting Activity of N -(Disubstituted-phenyl)-3-hydroxynaphthalene-2-carboxamides †.

Published in:

Molecules, 2021, v. 26, n. 14, p. 4336, doi. 10.3390/molecules26144336

By:

Kos, Jiri;
Gonec, Tomas;
Oravec, Michal;
Jendrzejewska, Izabela;
Jampilek, Josef

Publication type:

Article

Riminophenazine Derivatives as Potential Antituberculosis Agents: Synthesis, Biological, and Electrochemical Evaluations.

Published in:

Molecules, 2021, v. 26, n. 14, p. 4200, doi. 10.3390/molecules26144200

By:

Bvumbi, Mpelegeng Victoria;
van der Westhuyzen, Chris;
Mmutlane, Edwin M.;
Ngwane, Andile

Publication type:

Article

Efficacy of Natural Deep Eutectic Solvents for Extraction of Hydrophilic and Lipophilic Compounds from Fucus vesiculosus.

Published in:

Molecules, 2021, v. 26, n. 14, p. 4198, doi. 10.3390/molecules26144198

By:

Obluchinskaya, Ekaterina D.;
Pozharitskaya, Olga N.;
Zakharova, Lyubov V.;
Daurtseva, Anna V.;
Flisyuk, Elena V.;
Shikov, Alexander N.

Publication type:

Article

Identifying a Deferiprone–Resveratrol Hybrid as an Effective Lipophilic Anti-Plasmodial Agent.

Published in:

Molecules, 2021, v. 26, n. 13, p. 4074, doi. 10.3390/molecules26134074

By:

Maneekesorn, Supawadee;
Chuljerm, Hataichanok;
Koonyosying, Pimpisid;
Uthaipibull, Chairat;
Ma, Yongmin;
Srichairatanakool, Somdet

Publication type:

Article

Enhancement of the Antioxidant and Skin Permeation Properties of Betulin and Its Derivatives.

Published in:

Molecules, 2021, v. 26, n. 11, p. 3435, doi. 10.3390/molecules26113435

By:

Günther, Andrzej;
Makuch, Edyta;
Nowak, Anna;
Duchnik, Wiktoria;
Kucharski, Łukasz;
Pełech, Robert;
Klimowicz, Adam

Publication type:

Article

Synthesis and Evaluation of Novel 2,2-Dimethylthiochromanones as Anti-Leishmanial Agents.

Published in:

Molecules, 2021, v. 26, n. 8, p. 2209, doi. 10.3390/molecules26082209

By:

Coll, Seán;
Alhazmi, Mohammad;
de Aguiar Amaral, Patrícia;
Bourgeade-Delmas, Sandra;
Le Lamer, Anne-Cécile;
Barlow, James W.

Publication type:

Article

Encapsulation of Risperidone by Methylated β-Cyclodextrins: Physicochemical and Molecular Modeling Studies.

Published in:

Molecules, 2020, v. 25, n. 23, p. 5694, doi. 10.3390/molecules25235694

By:

Sbârcea, Laura;
Tănase, Ionuț-Mihai;
Ledeți, Adriana;
Cîrcioban, Denisa;
Vlase, Gabriela;
Barvinschi, Paul;
Miclău, Marinela;
Văruţ, Renata-Maria;
Trandafirescu, Cristina;
Ledeți, Ionuț;
Feczkó, Tivadar;
Biczók, László

Publication type:

Article

Biological Activities and ADMET-Related Properties of Novel Set of Cinnamanilides †.

Published in:

Molecules, 2020, v. 25, n. 18, p. 4121, doi. 10.3390/molecules25184121

By:

Kos, Jiri;
Bak, Andrzej;
Kozik, Violetta;
Jankech, Timotej;
Strharsky, Tomas;
Swietlicka, Aleksandra;
Michnova, Hana;
Hosek, Jan;
Smolinski, Adam;
Oravec, Michal;
Devinsky, Ferdinand;
Hutta, Milan;
Jampilek, Josef;
Vázquez, Julio A. A. Seijas

Publication type:

Article

Wide-Antimicrobial Spectrum of Picolinium Salts.

Published in:

Molecules, 2020, v. 25, n. 9, p. 2254, doi. 10.3390/molecules25092254

By:

Salajkova, Sarka;
Benkova, Marketa;
Marek, Jan;
Sleha, Radek;
Prchal, Lukas;
Malinak, David;
Dolezal, Rafael;
Sepčić, Kristina;
Gunde-Cimerman, Nina;
Kuca, Kamil;
Soukup, Ondrej;
Chang, Cheng-Wei Tom;
Takemoto, Jon Y.;
Zhan, Jixun

Publication type:

Article

N-Pyrazinoyl Substituted Amino Acids as Potential Antimycobacterial Agents—the Synthesis and Biological Evaluation of Enantiomers.

Published in:

Molecules, 2020, v. 25, n. 7, p. 1518, doi. 10.3390/molecules25071518

By:

Juhás, Martin;
Kučerová, Lucie;
Horáček, Ondřej;
Janďourek, Ondřej;
Kubíček, Vladimír;
Konečná, Klára;
Kučera, Radim;
Bárta, Pavel;
Janoušek, Jiří;
Paterová, Pavla;
Kuneš, Jiří;
Doležal, Martin;
Zitko, Jan;
Queiroz, Maria João

Publication type:

Article

Lignosulfonate Microcapsules for Delivery and Controlled Release of Thymol and Derivatives.

Published in:

Molecules, 2020, v. 25, n. 4, p. 866, doi. 10.3390/molecules25040866

By:

Piombino, Claudio;
Lange, Heiko;
Sabuzi, Federica;
Galloni, Pierluca;
Conte, Valeria;
Crestini, Claudia;
Barreiro, Maria Filomena

Publication type:

Article

Photocatalytic Difluoromethylation Reactions of Aromatic Compounds and Aliphatic Multiple C–C Bonds.

Published in:

Molecules, 2019, v. 24, n. 24, p. 4483, doi. 10.3390/molecules24244483

By:

Barata-Vallejo, Sebastián;
Postigo, Al;
Ravelli, Davide

Publication type:

Article

2-Arylidene-1-indandiones as Pleiotropic Agents with Antioxidant and Inhibitory Enzymes Activities †.

Published in:

Molecules, 2019, v. 24, n. 23, p. 4411, doi. 10.3390/molecules24234411

By:

Kouzi, Olympia;
Pontiki, Eleni;
Hadjipavlou-Litina, Dimitra;
Nicolotti, Orazio

Publication type:

Article

Lipophilicity Determination of Antifungal Isoxazolo[3,4-b]pyridin-3(1H)-ones and Their N1-Substituted Derivatives with Chromatographic and Computational Methods.

Published in:

Molecules, 2019, v. 24, n. 23, p. 4311, doi. 10.3390/molecules24234311

By:

Ciura, Krzesimir;
Fedorowicz, Joanna;
Andrić, Filip;
Žuvela, Petar;
Greber, Katarzyna Ewa;
Baranowski, Paweł;
Kawczak, Piotr;
Nowakowska, Joanna;
Bączek, Tomasz;
Sączewski, Jarosław;
Caballero, Julio

Publication type:

Article

Synthesis and Cyclooxygenase Inhibition of Sulfonamide-Substituted (Dihydro)Pyrrolo[3,2,1-hi]indoles and Their Potential Prodrugs.

Published in:

Molecules, 2019, v. 24, n. 20, p. 3807, doi. 10.3390/molecules24203807

By:

Laube, Markus;
Gassner, Cemena;
Kniess, Torsten;
Pietzsch, Jens;
Black, David StC

Publication type:

Article

Comparison of the Utility of RP-TLC Technique and Different Computational Methods to Assess the Lipophilicity of Selected Antiparasitic, Antihypertensive, and Anti-inflammatory Drugs.

Published in:

Molecules, 2019, v. 24, n. 17, p. 3187, doi. 10.3390/molecules24173187

By:

Pyka-Pająk, Alina;
Parys, Wioletta;
Dołowy, Małgorzata

Publication type:

Article

Bioactivity of Methoxylated and Methylated 1-Hydroxynaphthalene-2-Carboxanilides: Comparative Molecular Surface Analysis †.

Published in:

Molecules, 2019, v. 24, n. 16, p. 2991, doi. 10.3390/molecules24162991

By:

Michnová, Hana;
Pospíšilová, Šárka;
Goněc, Tomáš;
Kapustíková, Iva;
Kollár, Peter;
Kozik, Violetta;
Musioł, Robert;
Jendrzejewska, Izabela;
Vančo, Ján;
Trávníček, Zdeněk;
Čížek, Alois;
Bąk, Andrzej;
Jampílek, Josef;
Seijas Vázquez, Julio A. A.

Publication type:

Article

Diacetylcurcumin: Its Potential Antiarthritic Effect on a Freund's Complete Adjuvant-Induced Murine Model.

Published in:

Molecules, 2019, v. 24, n. 14, p. 2643, doi. 10.3390/molecules24142643

By:

Escobedo-Martínez, Carolina;
Guzmán-Gutiérrez, Silvia Laura;
Carrillo-López, María Isabel;
Deveze-Álvarez, Martha Alicia;
Trujillo-Valdivia, Alfonso;
Meza-Morales, William;
Enríquez, Raúl G.

Publication type:

Article

Fine-Tuning the Activation Mode of an 1,3-Indandione-Based Ruthenium(II)-Cymene Half-Sandwich Complex by Variation of Its Leaving Group.

Published in:

Molecules, 2019, v. 24, n. 13, p. 2373, doi. 10.3390/molecules24132373

By:

Mokesch, Stephan;
Schwarz, Daniela;
Hejl, Michaela;
Klose, Matthias H. M.;
Roller, Alexander;
Jakupec, Michael A.;
Kandioller, Wolfgang;
Keppler, Bernhard K.

Publication type:

Article

Discovery of Potent and Selective Halogen-Substituted Imidazole-Thiosemicarbazides for Inhibition of Toxoplasma gondii Growth In Vitro via Structure-Based Design.

Published in:

2019

By:

Paneth, Agata;
Węglińska, Lidia;
Bekier, Adrian;
Stefaniszyn, Edyta;
Wujec, Monika;
Trotsko, Nazar;
Hawrył, Anna;
Hawrył, Miroslaw;
Dzitko, Katarzyna

Publication type:

Advertising Review

Carpesium divaricatum Sieb. & Zucc. Revisited: Newly Identified Constituents from Aerial Parts of the Plant and Their Possible Contribution to the Biological Activity of the Plant.

Published in:

Molecules, 2019, v. 24, n. 8, p. 1614, doi. 10.3390/molecules24081614

By:

Kłeczek, Natalia;
Michalak, Barbara;
Malarz, Janusz;
Kiss, Anna Karolina;
Stojakowska, Anna

Publication type:

Article

Lipophilicity as a Central Component of Drug-Like Properties of Chalchones and Flavonoid Derivatives.

Published in:

Molecules, 2019, v. 24, n. 8, p. 1505, doi. 10.3390/molecules24081505

By:

Constantinescu, Teodora;
Lungu, Claudiu Nicolae;
Lung, Ildiko

Publication type:

Article

Multi-Target Cinnamic Acids for Oxidative Stress and Inflammation: Design, Synthesis, Biological Evaluation and Modeling Studies.

Published in:

Molecules, 2019, v. 24, n. 1, p. 12, doi. 10.3390/molecules24010012

By:

Pontiki, Eleni;
Hadjipavlou-Litina, Dimitra

Publication type:

Article

Selective Synthesis of 3-O-Palmitoyl-Silybin, a New-to-Nature Flavonolignan with Increased Protective Action against Oxidative Damages in Lipophilic Media.

Published in:

Molecules, 2018, v. 23, n. 10, p. 2594, doi. 10.3390/molecules23102594

By:

Drouet, Samantha;
Doussot, Joël;
Garros, Laurine;
Mathiron, David;
Bassard, Solène;
Favre-Réguillon, Alain;
Molinié, Roland;
Lainé, Éric;
Hano, Christophe

Publication type:

Article

Hits-to-Lead Optimization of the Natural Compound 2,4,6-Trihydroxy-3-geranyl-acetophenone (tHGA) as a Potent LOX Inhibitor: Synthesis, Structure-Activity Relationship (SAR) Study, and Computational Assignment.

Published in:

Molecules, 2018, v. 23, n. 10, p. 2509, doi. 10.3390/molecules23102509

By:

Ng, Chean Hui;
Rullah, Kamal;
Abas, Faridah;
Lam, Kok Wai;
Ismail, Intan Safinar;
Jamaludin, Fadzureena;
Shaari, Khozirah

Publication type:

Article

Facile Synthesis of Flexible Methylsilsesquioxane Aerogels with Surface Modifications for Sound- Absorbance, Fast Dye Adsorption and Oil/Water Separation.

Published in:

Molecules, 2018, v. 23, n. 4, p. 945, doi. 10.3390/molecules23040945

By:

Guo, Xingzhong;
Shan, Jiaqi;
Lai, Zhongzhang;
Lei, Wei;
Ding, Ronghua;
Zhang, Yun;
Yang, Hui

Publication type:

Article

Lipase-Produced Hydroxytyrosyl Eicosapentaenoate is an Excellent Antioxidant for the Stabilization of Omega-3 Bulk Oils, Emulsions and Microcapsules.

Published in:

Molecules, 2018, v. 23, n. 2, p. 275, doi. 10.3390/molecules23020275

By:

Akanbi, Taiwo Olusesan;
Barrow, Colin James

Publication type:

Article

Synthesis and Evaluation of the Antioxidant Activity of Lipophilic Phenethyl Trifluoroacetate Esters by In Vitro ABTS, DPPH and in Cell-Culture DCF Assays.

Published in:

Molecules, 2018, v. 23, n. 1, p. 208, doi. 10.3390/molecules23010208

By:

Bernini, Roberta;
Barontini, Maurizio;
Cis, Valentina;
Carastro, Isabella;
Tofani, Daniela;
Chiodo, Rosa Anna;
Lupattelli, Paolo;
Incerpi, Sandra

Publication type:

Article

Synthesis and In Vitro Antimycobacterial Activity of Novel N-Arylpiperazines Containing an Ethane-1,2-diyl Connecting Chain.

Published in:

Molecules, 2017, v. 22, n. 12, p. 2100, doi. 10.3390/molecules22122100

By:

Gonĕc, Tomáš;
Malík, Ivan;
Csöllei, Jozef;
Jampílek, Josef;
Stolaříková, Jiřina;
Solovič, Ivan;
Mikuš, Peter;
Keltošová, Stanislava;
Kollár, Peter;
O'Mahony, Jim;
Coffey, Aidan

Publication type:

Article

Synthesis, Analysis, Cholinesterase-Inhibiting Activity and Molecular Modelling Studies of 3-(Dialkylamino)-2-hydroxypropyl 4-[(Alkoxycarbonyl) amino]benzoates and Their Quaternary Ammonium Salts.

Published in:

Molecules, 2017, v. 22, n. 12, p. 2048, doi. 10.3390/molecules22122048

By:

Padrtova, Tereza;
Marvanova, Pavlina;
Odehnalova, Klara;
Kubinova, Renata;
Parravicini, Oscar;
Garro, Adriana;
Enriz, Ricardo D.;
Humpa, Otakar;
Oravec, Michal;
Mokry, Petr

Publication type:

Article

Enhanced Antibacterial Activity of Ent-Labdane Derivatives of Salvic Acid (7α-Hydroxy-8(17)-ent-Labden-15-Oic Acid): Effect of Lipophilicity and the Hydrogen Bonding Role in Bacterial Membrane Interaction.

Published in:

Molecules, 2017, v. 22, n. 7, p. 1039, doi. 10.3390/molecules22071039

By:

Echeverría, Javier;
Urzúa, Alejandro;
Sanhueza, Loreto;
Wilkens, Marcela

Publication type:

Article

Identification of Onosma visianii Roots Extract and Purified Shikonin Derivatives as Potential Acaricidal Agents against Tetranychus urticae.

Published in:

Molecules, 2017, v. 22, n. 6, p. 1002, doi. 10.3390/molecules22061002

By:

Sut, Stefania;
Pavela, Roman;
Kolarčik, Vladislav;
Cappellacci, Loredana;
Petrelli, Riccardo;
Maggi, Filippo;
DallÁcqua, Stefano;
Benelli, Giovanni

Publication type:

Article

Lipophilicity Studies on Thiosemicarbazide Derivatives.

Published in:

Molecules, 2017, v. 22, n. 6, p. 952, doi. 10.3390/molecules22060952

By:

Paneth, Agata;
Hawrył, Anna;
Plech, Tomasz;
Hawrył, Mirosław;
Świeboda, Ryszard;
Janowska, Dominika;
Wujec, Monika;
Paneth, Piotr

Publication type:

Article

Structure-Activity and Lipophilicity Relationships of Selected Antibacterial Natural Flavones and Flavanones of Chilean Flora.

Published in:

Molecules, 2017, v. 22, n. 4, p. 608, doi. 10.3390/molecules22040608

By:

Echeverría, Javier;
Opazo, Julia;
Mendoza, Leonora;
Urzúa, Alejandro;
Wilkens, Marcela

Publication type:

Article

Assessment of Lipophilicity Indices Derived from Retention Behavior of Antioxidant Compounds in RP-HPLC.

Published in:

Molecules, 2017, v. 22, n. 4, p. 550, doi. 10.3390/molecules22040550

By:

Sima, Ioana Anamaria;
Kot-Wasik, Agata;
Wasik, Andrzej;
Namie'snik, Jacek;
Sârbu, Costel

Publication type:

Article

Metabolite Profiling of Eastern Teaberry (Gaultheria procumbens L.) Lipophilic Leaf Extracts with Hyaluronidase and Lipoxygenase Inhibitory Activity.

Published in:

Molecules, 2017, v. 22, n. 3, p. 412, doi. 10.3390/molecules22030412

By:

Michel, Piotr;
Owczarek, Aleksandra;
Matczak, Magdalena;
Kosno, Martyna;
Szymański, Paweł;
Mikiciuk-Olasik, Elżbieta;
Kilanowicz, Anna;
Wesołowski, Wiktor;
Olszewska, Monika A.

Publication type:

Article

2D-QSAR and 3D-QSAR/CoMSIA Studies on a Series of (R)-2-((2-(1H-Indol-2-yl)ethyl)amino)-1-Phenylethan-1-ol with Human β<sub>3</sub>-Adrenergic Activity.

Published in:

Molecules, 2017, v. 22, n. 3, p. 404, doi. 10.3390/molecules22030404

By:

Apablaza, Gastón;
Montoya, Luisa;
Morales-Verdejo, Cesar;
Mellado, Marco;
Cuellar, Mauricio;
Lagos, Carlos F.;
Soto-Delgado, Jorge;
Chung, Hery;
Pessoa-Mahana, Carlos David;
Mella, Jaime

Publication type:

Article

Synthesis and Determination of Physicochemical Properties of New 3-(4-Arylpiperazin-1-yl)-2- hydroxypropyl 4-Alkoxyethoxybenzoates.

Published in:

Molecules, 2016, v. 21, n. 12, p. 1682, doi. 10.3390/molecules21121682

By:

Marvanova, Pavlina;
Padrtova, Tereza;
Odehnalova, Klara;
Hosik, Ondrej;
Oravec, Michal;
Mokry, Petr

Publication type:

Article

N-Alkoxyphenylhydroxynaphthalenecarboxamides and Their Antimycobacterial Activity.

Published in:

Molecules, 2016, v. 21, n. 8, p. 1068, doi. 10.3390/molecules21081068

By:

Gonec, Tomas;
Pospisilova, Sarka;
Kauerova, Tereza;
Kos, Jiri;
Dohanosova, Jana;
Oravec, Michal;
Kollar, Peter;
Coffey, Aidan;
Liptaj, Tibor;
Cizek, Alois;
Jampilek, Josef

Publication type:

Article

Theoretical Study of Molecular Structure and Physicochemical Properties of Novel Factor Xa Inhibitors and Dual Factor Xa and Factor IIa Inhibitors.

Published in:

Molecules, 2016, v. 21, n. 2, p. 185, doi. 10.3390/molecules21020185

By:

Remko, Milan;
Remková, Anna;
Broer, Ria

Publication type:

Article

Supplementary Material: A Comparative Study between the Lipophylicity of Some Thiazolyl-Carbonyl-Thiosemicarbazides and Thiazolyl-Azoles and Their Anti-Inflammatory and Antioxidant Activities.

Published in:

2015

By:

Tamaian, Radu;
Moţ, Augustin;
Silaghi-Dumitrescu, Radu;
Ionuţ, Ioana;
Stana, Anca;
Oniga, Ovidiu;
Nastasă, Cristina;
Benedec, Daniela;
Tiperciuc, Brînduşa

Publication type:

Chart/Diagram/Graph

Study of the Relationships between the Structure, Lipophilicity and Biological Activity of Some Thiazolyl-carbonyl-thiosemicarbazides and Thiazolyl-azoles.

Published in:

Molecules, 2015, v. 20, n. 12, p. 22188, doi. 10.3390/molecules201219841

By:

Tamaian, Radu;
Moţ, Augustin;
Silaghi-Dumitrescu, Radu;
Ionuţ, Ioana;
Stana, Anca;
Oniga, Ovidiu;
Nastasă, Cristina;
Benedec, Daniela;
Tiperciuc, Brînduşa

Publication type:

Article