Molinspiration Publications 2014 |
Antibacterial and cytotoxic activities of Schiff base analogues of 4-aminoantipyrine
MS Alam, DU Lee, ML Bari - Journal of the Korean Society for Applied …
Molecular docking studies of antidiabetic activity of cinnamon compounds
J Ganugapati, S Swarna - Asian Journal of Pharmaceutical …
INSILCO IDENTIFICATION OF SUITABLE ACETUYLCHOLINESTERASE INHIBITORS FROM MORINDA CITRIFOLIA LINN. WITH REFERENCE TO ALZHEIMER'S …
K Praveen, K Yellamma - International Journal of …
Docking study of some Glutamic acid derivatives as potent antineoplastic agents
S DUTTAA, S RAYB, K Nagarajanc - Int. J. Pharm. Pharm. Sci
QSAR AND SYNTHESIS OF NOVEL DOPAMINE TRANSPORTER INHIBITORS
KNW C'ierra Link, J Keith - okdspace.wssu.edu
Computational analysis of Organobismuth compounds and their potential application as anti-tumor agents
S Lal, A Chattree, SH Khan… - International Journal of …
International Journal of Pharmacy
J Ganugapati, A Battu, A Aare - Citeseer
Rational design and synthesis of benzimidazole derivatives for the evaluation of biological activity
A Sandala -
Molecular Properties and Docking Studies of Benzimidazole Derivatives as Potential Peptide Deformylase Inhibitors
K Hemalatha, V Chakkaravarthi… - Asian Journal of …
Synthesis, alkylating activity and physicochemical study of nitrogen mustard agent for brain delivery
RK Singh - International Journal
Correlation studies between ADMET properties, drug-likeness scores and molecular descriptors in a series of protein tyrosine kinase inhibitors
MJM Takač, V Takač, M Barbarić… - 2nd International …
Antiviral activity of Ellagic Acid against envelope proteins from Dengue Virus through Insilico Docking
G Bupesh, RS Raja, K Saravanamurali… - International Journal of …
IN-SILICO ESTIMATION ON ORAL BIOAVAILABILITY AND DRUG-LIKENESS OF MONO AND BIS-MANNICH BASES OF PIPERAZINE DERIVATIVES
G Prasanthi - jgtps.com
SYNTHESIS, CHARACTERISATION AND BIOLOGICAL EVALUATION OF SOME PYRAZOLONE DERIVATIVES SYNTHESIS, CHARACTERISATION AND …
C Buvana, A Sumathy, AMSAM Sunny, M Sukumar - Citeseer
Comparative assessment of in vitro and in vivo biological activity of some anthracene-derived aminophosphonates, bis-aminophosphonates and poly ( …
M Topashka-Ancheva, B Nikolova-Mladenova… - bioscience.scientific-journal.com
In silico design and computational study of novel 1, 3, 4-thiadiazole derivatives as potential affinity with Na/H exchanger receptor for anticonvulsant activity
V Raj, A Rai, JK Rawat - PharmaTutor
In silico analysis to compare the effectiveness of assorted drugs prescribed for swine flu in diverse medicine systems
K Raja, A Prabahar, S Selvakumar… - Indian journal of …
Docking Study of Inhibition Activity of Biflavonoids against COX-1 Receptor
G Siva, K Vetrivelmurugan, K Vinothkumar… - Journal of Advanced …
New eco-friendly 1-alkyl-3-(4-phenoxybutyl) imidazolium-based ionic liquids derivatives: A green ultrasound-assisted synthesis, characterization, antibacterial …
M Messali, MR Aouad, WS El-Sayed, A Al-Sheikh Ali… - Molecules
In silico evaluation of angiotensin II receptor antagonist's plasma protein binding using computed molecular descriptors
J Odović, J Trbojević-Stanković - Acta Medica Medianae
Ligand based Virtual Screening and Pharmacophore Studies of Aminobisphosphonate for FPPS Inhibitors as Anticancer Targets
M MESMOUDI, I DAOUD, S GHALEM - Journal: Journal of Advances in … - researchgate.net
Three-parameter modeling of the soil sorption of acetanilide and triazine herbicide derivatives
MR Freitas, SVBG Matias, RLG Macedo… - Bulletin of environmental …
Molecular docking analysis of curcumin analogues as human neutrophil elastase inhibitors
R Narayanaswamy, LK Wai, F Abas… - Bangladesh Journal …
Identification of Novel Dihydrofolate Reductase Inhibitor as Potential Antimalarial Drug: In silico Studies
Z Iqbal, M Hassan, J Munir, IM Farah… - Pakistan Journal of …
Computational evaluation and experimental verification of antibacterial and antioxidant activity of 7-hydroxy-3-pyrazolyl-4H-chromen-4-ones and their o-glucosides: …
J Sheikh, K Hatzade, A Bader, U Shaheen… - Medicinal Chemistry …
Discovery of Potential, Non‐Toxic Influenza Virus Inhibitor by Computational Techniques
V Karthick, AP Toropova, AA Toropov… - Molecular …
Substituted thieno [2, 3-b] thiophenes and related congeners: Synthesis, β-glucuronidase inhibition activity, crystal structure, and POM analyses
YN Mabkhot, A Barakat, S Yousuf, MI Choudhary… - Bioorganic & medicinal …
Cytotoxicity and genotoxicity of phenazine in two human cell lines
CF McGuigan, XF Li - Toxicology in Vitro
SYNTHESIS, CYTOTOXIC EVALUATION AND MOLECULAR PROPERTIES STUDIES OF NOVEL BENZIMIDAZOLE DERIVATIVES WITH DITHIOCARBAMATE …
TS Jyostna, G Achaiah - pharmacophorejournal.com
In silico docking studies of selected flavonoids-Natural healing agents against breast cancer
J Suganya, M Radha, DL Naorem… - Asian Pac J Cancer …
Macrocystis angustifolia is a potential source of enzyme inhibitors linked to type 2 diabetes and dementia
KRR Rengasamy, MA Aderogba, SO Amoo… - Journal of Applied …
Xanthenedione derivatives, new promising acetylcholinesterase inhibitor agents
A Seca, S Leal, D Pinto, M do Carmo Barreto… - Planta …
STRUCTURE BASED DRUG DESIGN FROM PANDURATIN A AGAINST NS2B/NS3 PROTEIN
P Parida, RNS Yadav - Indo American Journal of Pharmaceutical …
QSAR Studies of the impact of structural features of benzodiazepine drugs on their toxicity
E Pajazetović -
Design, synthesis and evaluation of Schiff bases & thiazolidinone derivatives for anticonvulsant activity.
N Batra, S Batra, BP Nagori -
Studies on molecular properties prediction, antitubercular and antimicrobial activities of novel quinoline based pyrimidine motifs
NC Desai, GM Kotadiya, AR Trivedi - Bioorganic & medicinal chemistry …
Computational POM evaluation of experimental in vitro Trypanosoma cruzi and Mycobacterium tuberculosis inhibition of heterocyclic-2-carboxylic acid (3-cyano-1, 4- …
TB Hadda, H Bendaha, J Sheikh, M Ahmad… - Medicinal Chemistry …
Design, synthesis, and evaluation of isoniazid derivatives acting as potent anti-inflammatory and anthelmintic agents via Betti reaction
I Mohanram, J Meshram - Medicinal Chemistry Research
Journal of Chemical and Pharmaceutical Research, 2014, 6 (11): 493-499
A Nag, A Mukherjee - Journal of Chemical and Pharmaceutical …
Molecular mechanisms involved in the cytotoxicity induced by coumarins from Calophyllum brasiliense in K562 leukaemia cells
JC Gomez‐Verjan, EA Estrella‐Parra… - Journal of Pharmacy …
Inhibitors of the glyoxylate cycle enzyme ICL1 in Candida albicans for potential use as antifungal agents
HL Cheah, V Lim, D Sandai - PloS one
IN-SILICO DOCKING INVESTIGATION, SYNTHESIS AND INVITRO ANTICANCER STUDY OF BENZOXAZOLE DERIVATIVES
G Shitha, VKKB AMMA, G BABU… - Journal of Drug Delivery …
P1 and P1′ para-fluoro phenyl groups show enhanced binding and favorable predicted pharmacological properties: Structure-based virtual screening of extended …
RS Yedidi, Z Liu, IA Kovari, PM Woster… - Journal of Molecular …
ANTIMICROBIAL ACTIVITY AND DRUG-LIKENESS OF 4, 5-DISUBSTITUTED 1-(PHENYL)-1H-1, 2, 3-TRIAZOLE ANALOGUES
MS Alam, Y Ozoe - researchgate.net
Prediction of In-silico ADME Properties of 1, 2-O-Isopropylidene Aldohexose Derivatives
SZ Kovačević, LR Jevrić, SOP Kuzmanović… - Iranian journal of …
Journal of Chemical and Pharmaceutical Research, 2014, 6 (3): 1273-1278
S Sajitha Lulu, A Shamundeeswari… - Journal of Chemical …
In vitro phenotypic screening of 7-chloro-4-amino (oxy) quinoline derivatives as putative anti-Trypanosoma cruzi agents
C Fonseca-Berzal, FAR Ruiz, JA Escario… - Bioorganic & medicinal …
Molecular modeling of a series of pyridinecarboxamidrazone-azole derivatives with antifungal activity
L Terra, HC Castro, PA Abreu - Medicinal Chemistry Research
Drug analogs of COX-2 selective inhibitors lumiracoxib and valdecoxib derived from in silico search and optimization
R Bartzatt - Anti-Inflammatory & Anti-Allergy Agents in …
An in silico approach to discover potential inhibitors against multi_drug resistant bacteria producing new-delhi metallo-β-lactamase 1 (ndm-1) enzyme
H Chetia, DK Sharma, R Sarma, A Verma - Int J Pharm Pharm Sci
Energy transfer in aggregates of bacteriochlorophyll c self-assembled with azulene derivatives
M Matěnová, VL Horhoiu, FX Dang… - Physical Chemistry …
POM analyses of antimicrobial activity of some 2, 3-armed 4, 5, 6, 7-tetrahydro-1-benzothiophenes: favourable and unfavourable physico-chemical parameters in …
TB Hadda, S Srivastava, B Das… - Medicinal Chemistry …
V Baskar, C Jayalakshmi… - … of Biological & …, 2014 - BioLim Publishing & Education …
SA Bai, SJ Tangeda, M Madhavi… - INDIAN …
IN-SILICO DESIGN, SYNTHESIS AND IN VITRO ANTITUBERCULAR ACTIVITY OF NOVEL 1, 2, 4-TRIAZOLE DERIVATIVES
K Arul, AA Smith - International Journal of Pharmacy and …
Virtual screening of compounds derived from Garcinia pedunculata as an inhibitor of gamma hemolysin component A of Staphylococcus aureus
T Chowdhury - Bangladesh Journal of Pharmacology
Pharmacophore Modeling and Molecular Docking Studies on Pinus roxburghii as a Target for Diabetes Mellitus
P Kaushik, S Lal Khokra, AC Rana… - Advances in …
Microwave assisted synthesis and docking study of N-(2-oxo-2-(4-oxo-2-substituted thiazolidin-3ylamino) ethyl) benzamide derivatives as anticonvulsant agents
APG Nikalje, AN Shaikh, SI Shaikh, FAK Khan… - Bioorganic & medicinal …
An Insilico Appraisal of Few Bioactive Compounds against Beta Keto Acyl ACP Synthase III for Antitubercular Efficacy
C Buvana, S Srinivasan, VS Shruthy… - Asian Journal of …
Drug-like Properties of Some Esters of ortho-/meta-/para-Alkoxyphenylcarbamic Acid Containing N-Phenylpiperazine Fragment
I Malík - Global Journal of Medical Research
RP-HPTLC Retention Data in Correlation with the In-silico ADME Properties of a Series of s-triazine Derivatives
LR Jevrić, SO Podunavac-Kuzmanović… - Iranian journal of …
Two Novel Alkylating Structural Analogues of Chloramphenicol Suitable for Topical Treatment of Dermal Neoplasms
R Bartzatt - Journal of Advances in Medical and Pharmaceutical …
Protein Arginine N‐Methyltransferase Substrate Preferences for Different Nη‐Substituted Arginyl Peptides
D Thomas, T Koopmans, TM Lakowski… - …
SYNTHESIS, BIOLOGICAL EVALUATION AND MOLECULAR PROPERTIES PREDICTION OF TRISUBSTITUTED PYRIMIDINES
S Hemalatha, B Lakshmi, V Jyothia… - Indo American Journal …
Synthesis of 1H‐Imidazoles Catalyzed by Cu‐Nanoparticle and Its Physicochemical Properties
R Pagadala, NV Gandhare… - Journal of …
IN-SILICO DESIGN, SYNTHESIS AND IN VITRO ANTICANCER AND ANTITUBERCULAR ACTIVITY OF NOVEL AZETIDINONE CONTAINING ISATIN DERIVATIVES
K Arul, KS Sunisha, J Kumaran - International Journal of …
POM analyses for antimicrobial evaluation of thienopyrimidinones derivatives: a rapid method for drug design
TB Hadda, M Ahmad, S Sultana, U Shaheen… - Medicinal Chemistry …
SYNTHESIS, BIOLOGICAL EVALUATION AND MOLECULAR PROPERTIES PREDICTION OF 1, 3, 5-TRISUBSTITUTED 2-PYRAZOLINE DERIVATIVES
H Sattu, B Lakshmi, R Prasad - ijpsr.com
Moulay H. Youssoufi, Taibi Ben Hadda, Ismail Warad, Muhammad Moazzam Naseer, Yahia Nasser Mabkhot &
A Bader - researchgate.net
Antiproliferative Activity of 2, 3, 6, 7-Tetrahydro-1H-benzo [a] quinolizino [1, 9-hi] phenoxazin-14 (5H)-iminium Chloride Derivatives
MI Leitão, BR Raju, MJ Sousa, MST Gonçalves - 18th Electronic Conference …
Identification of Novel Hepatitis C virus NS3-4A protease inhibitors by virtual screening approach
A Kumar, R Gupta, K Verma, K Iyer… - Journal of Microbial & …
Design of Multi-Target Compounds as AChE, BACE1, and Amyloid-β1-42 Oligomerization Inhibitors: In Silico and In Vitro Studies
M Hernández-Rodríguez… - Journal of …
IN-SILICO DESIGN, SYNTHESIS AND IN VITRO ANTICANCER EVALUATION OF SOME NOVEL 1, 2, 4-TRIAZOLE DERIVATIVES
AA Smith - experimentjournal.com
DESIGN, SYNTHESIS AND BIOLOGICAL EVALUATION OF STEROIDAL TETRAZOLES AS ANTIPROLIFERATIVE AND ANTIOXIDANT AGENTS
M Asif, A Ali, A Mashrai, H Khanam… - European Chemical …
Fused heterocyclic compounds bearing bridgehead nitrogen as potent HIV-1 NNRTIs. Part 1: design, synthesis and biological evaluation of novel 5, 7-disubstituted …
Y Tian, D Du, D Rai, L Wang, H Liu, P Zhan… - Bioorganic & medicinal …
Molecular Modeling and Docking Analysis of CYP1A1 Associated with Head and Neck Cancer to Explore its Binding Regions
SA Sehgal, RA Tahir, S Shafique… - Journal of Theoretical …
Estimation of Lipophilicity and Retention Behavior of Some Alpha Adrenergic and Imidazoline Receptor Ligands Using RP-TLC
MS Mohamed Shenger, S Filipic, K Nikolic… - Journal of Liquid …
Alkamides from Echinacea disrupt the fungal cell wall-membrane complex
I Cruz, JJ Cheetham, JT Arnason, JE Yack, ML Smith - Phytomedicine
Screening of Bioactive Compounds against Nonreceptor Fyn Kinase: Virtual Screening and Network Approach
T Amalraj, S Kumari, S Lulu, M Arumugam - International Journal for …
Phenylboronic Acid-Installed Polycarbonates for the pH-Dependent Release of Diol-Containing Molecules
YE Aguirre-Chagala, JL Santos, Y Huang… - ACS Macro …
Siham Lahsasni, Taibi Ben Hadda, Vijay Masand, Naziyanaz B. Pathan, Ali Parvez, Ismail Warad, Usama Shaheen
A Bader - researchgate.net
Impact of geometric parameters, charge, and lipophilicity on bioactivity of armed quinoxaline, benzothiaole, and benzothiazine: POM analyses of antibacterial and …
TB Hadda, FZ Khardli, M Mimouni… - … , Sulfur, and Silicon …
In-Silico search of Tailored Cox-2 Inhibitors: Screening of Quinazolinone derivatives via molecular modeling Tools
S Abdul, A Bahar, H Mohsin, H Anzarul - International Journal of Drug …
Determination of Dermal Permeability Coefficient (Kp) by Utilizing Multiple Descriptors in Artificial Neural Network Analysis and Multiple Regression Analysis
R Bartzatt - researchgate.net
Modelling passive absorption properties of phytochemicals using physicochemical properties
SN Selby-Pham, FR Dunshea, KS Howell… - … Lives, Livelihoods and …
A SAM-dependent methyltransferase cotranscribed with arsenate reductase alters resistance to peptidyl transferase center-binding antibiotics in Azospirillum …
S Singh, C Singh, AK Tripathi - Applied microbiology and biotechnology
Lipophilization of ascorbic acid: A monolayer study and biological and antileishmanial activities
N Kharrat, I Aissa, M Sghaier, M Bouaziz… - Journal of agricultural …
Antimicrobial activity of naturally occurring antibiotics Monensin, Lasalocid and their metal complexes
M Mimouni, FZ Khardli, I Warad, M Ahmad… - J. Mater. Environ. …
Facile and efficient preparation of hybrid phenylthiazolyl-1, 3, 5-triazines and their antidepressant-like effect in mice
A Gahtori, A Kumar, P Kothiyal, P Gahtori - Tetrahedron Letters
De novo design and in-silico studies of novel bis-arylpiperazine derivatives as non-nucleoside inhibitors of HIV-1 reverse transcriptase
A Yadav, S Chander, H Lathiya, H Sharma… - Journal of …
SYNTHESIS AND EVALUATION OF 2-AMINO-5-(PYRIDIN-3YL)-1, 3, 4 THIADIAZOLE DERIVATIVES
K Rajitha, M Sreejith, R Raju - Journal of …
Design, Synthesis and Evaluation of New 2, 6-Dihydroimidazo [1, 2-c] Pyrimido [5, 4-e]-Pyrimidine-5 (3H)-thiones as Possible Antihistaminic/Antiasthmatic …
K Sirisha, G Achaiah, ARR Rao - Indian journal of pharmaceutical …
Ginger components as new leads for the design and development of novel multi-targeted anti-Alzheimer's drugs: a computational investigation
F Azam, AM Amer, AR Abulifa… - … design, development and …
Pharmacoinformatics elucidation of potential drug targets against migraine to target ion channel protein KCNK18
SA Sehgal, M Hassan, S Rashid - Drug design, development and …
Moulay H. Youssoufi, Pramod K. Sahu, Praveen K. Sahu, Dau D. Agarwal, Mushtaq Ahmad, Mouslim Messali
S Lahsasni - researchgate.net
Synthesis and biological activities of 4-aminoantipyrine derivatives derived from betti-type reaction
I Mohanram, J Meshram - ISRN organic chemistry
Synthesis, characterization and in vitro anticancer activity of C-5 curcumin analogues with potential to inhibit TNF-α-induced NF-κB activation
A Anthwal, BK Thakur, MSM Rawat… - BioMed research …
Exploring N-acylhydrazone derivatives against clinical resistant bacterial strains
AC Lannes, B Leal, JS Novais, V Lione… - Current …
Glycyrrhetinic acid and E. resveratroloside act as potential plant derived compounds against dopamine receptor D3 for Parkinson's disease: a pharmacoinformatics …
MU Mirza, AM Mirza, NUH Ghori… - Drug design, …
A comparative ex vivo drug permeation study of beta-blockers through porcine buccal mucosa
S Amores, J Lauroba, A Calpena, H Colom… - International journal of …
Natural product mixture analysis by matrix-assisted DOSY using Brij surfactants in mixed solvents
MGS Vieira, NV Gramosa, NMPS Ricardo, GA Morris… - RSC Advances
Synthesis and evaluation of a 18 F-curcumin derivate for β-amyloid plaque imaging
J Rokka, A Snellman, C Zona, B La Ferla… - Bioorganic & medicinal …
Isovitexin from Kigelia pinnata, a potential eco-friendly nematicidal agent
O Atolani, OA Fabiyi, GA Olatunji - Trop Agric
Relationships between Molecular Descriptors, Drug-likeness, ADMET Parameters and Biological Activity of Tyrosine Kinase Inhibitors in a Series of Quinoline, …
MJM Takac, V Takac, M Barbaric… - … 2020–The Rise of a New …
Fluorophore‐Labeled Cyclooxygenase‐2 Inhibitors for the Imaging of Cyclooxygenase‐2 Overexpression in Cancer: Synthesis and Biological Studies
A Bhardwaj, J Kaur, F Wuest, EE Knaus - ChemMedChem
Synthesis, characterization, and antibacterial activity of a novel heterocyclic Schiff's base and its metal complexes of first transition series
RP Saini, V Kumar, AK Gupta, GK Gupta - Medicinal Chemistry Research
Synthesis and effect of substituent position on anti-inflammatory activity of 3-(halobenzyl) isocarbostyrils
TM Babar, MM Naseer, FI Ali, NH Rama… - Medicinal Chemistry …
Optimization of 6-Heterocyclic-2-(1 H-pyrazol-1-yl)-N-(pyridin-2-yl) pyrimidin-4-amine as Potent Adenosine A2A Receptor Antagonists for the Treatment of Parkinson's …
J Zheng, Z Yang, X Li, L Li, H Ma, M Wang… - ACS chemical …
Design, Synthesis and Screening of Newer-8-Hydroxy Quinoline Derivatives as Novel Anti Tubercular Agents
SR Surekha, L Joseph, M George - International Journal of Applied …
Reversible redox system-based drug design, synthesis, and evaluation for targeting nitrogen mustard across brain
RK Singh, S Kumar, DN Prasad… - Medicinal Chemistry …
C5-curcuminoid-dithiocarbamate based molecular hybrids: synthesis and anti-inflammatory and anti-cancer activity evaluation
A Anthwal, K Singh, MSM Rawat, AK Tyagi… - RSC Advances
Design, synthesis, chemical and biological evaluation of brain targeted alkylating agent using reversible redox prodrug approach
RK Singh, DN Prasad, TR Bhardwaj - Arabian Journal of Chemistry
Substituted phenyl containing 1, 3, 4-oxadiazole-2-yl-but-2-enamides: synthesis and preliminary evaluation as promising anticonvulsants
N Siddiqui, MJ Akhtar, MS Yar, P Ahuja… - Medicinal Chemistry …
Activation energies of diffusion of organic migrants in cyclo olefin polymer
F Welle - International journal of pharmaceutics
Isolation and evaluation of antiglycation potential of polyalthic acid (furano-terpene) from Daniella oliveri
O Atolani, GA Olatunji - Journal of Pharmaceutical Analysis
Design, synthesis and anticonvulsant activity of some new 6, 8-halo-substituted-2h-[1, 2, 4] triazino [5, 6-b] indole-3 (5h)-one/-thione and 6, 8-halo-substituted …
R Kumar, T Singh, H Singh, S Jain, RK Roy - EXCLI journal
Synthesis, antibacterial screening, and POM analyses of novel bis-isoxazolyl/pyrazolyl-1, 3-diols
H Juneja, D Panchbhai, J Sheikh, V Ingle… - Medicinal Chemistry …
Interfaces of dicationic ionic liquids and graphene: a molecular dynamics simulation study
S Li, G Feng, PT Cummings - Journal of Physics: Condensed …
Synthesis and biological evaluation of 2-Aminobenzamide derivatives as antimicrobial agents: Opening/Closing pharmacophore site
YN Mabkhot, AM Al-Majid, A Barakat… - International journal of …
Synthesis, Antileishmanial Activity and Docking Study of N′-Substitutedbenzylidene-2-(6, 7-dihydrothieno [3, 2-C] pyridin-5 (4H)-yl) acetohydrazides
JN Sangshetti, RI Shaikh, FAK Khan, RH Patil… - Bioorganic & medicinal …
In vitro modeling of angiotensin-converting enzyme inhibitor's absorption with chromatographic retention data and selected molecular descriptors
J Odović, B Marković, S Vladimirov… - … of Chromatography B
ИССЛЕДОВАНИЕ ЗАВИСИМОСТИ «ХИМИЧЕСКАЯ СТРУКТУРА-АНТИГИПОКСИЧЕСКОЕ ДЕЙСТВИЕ» В РЯДУ ПРОИЗВОДНЫХ ИНДОЛА И 2-ОКСИНДОЛА, …
РГ РЕДЬКИН, ВП ЧЕРНЫХ, ЛА ШЕМЧУК… - ЖУРНАЛ ОРГАНІЧНОЇ …
Diseño de moléculas con potencial terapéutico para la enfermedad de Parkinson debida a la sobreexpresión de PARP-1 a partir del análisis del acoplamiento …
A Durand-Silva, S Pérez-Gulias, E Mauriño-Reyes… - academia.edu
De novo design and in-silico studies of novel 1-phenyl-2, 3, 4, 9-tetrahydro-1H-pyrido [3, 4-b] indole-3-carboxylic acid derivatives as HIV-1 reverse transcriptase …
A Penta, S Chander, S Ganguly… - Medicinal Chemistry …
Molecular Docking study of Catechins compounds from Camellia sinensis against UPPS in Staphylococcus aureus
A Parimelzanghan, P Lavanya, A Anbarasu… - International Journal for …
Catalyst Promoted Synthesis, Computational and Enzyme Inhibition Studies of Coumarin Esters
M Parveen, F Ahmad, AM Malla, M Alam, DU Lee - Catalysis Letters
Cyclodidepsipeptides with a promising scaffold in medicinal chemistry
A Smelcerovic, P Dzodic, V Pavlovic, E Cherneva… - Amino acids
Strain‐Based In Situ Study of Anion and Cation Insertion into Porous Carbon Electrodes with Different Pore Sizes
JM Black, G Feng, PF Fulvio… - Advanced Energy …
Photodynamic inactivation of bioluminescent Escherichia coli by neutral and cationic pyrrolidine-fused chlorins and isobacteriochlorins
MQ Mesquita, JC Menezes, MG Neves… - Bioorganic & medicinal …
Non-linear assessment of anticancer activity of 17-picolyl and 17-picolinylidene androstane derivatives–Chemometric guidelines for further syntheses
SZ Kovačević, SO Podunavac-Kuzmanović… - European Journal of …
Analyzing methods for path mining with applications in metabolomics
S Tagore, N Chowdhury, RK De - Gene
MOLECULAR MODELLING STUDIES, SYNTHESIS AND ANTIMICROBIAL SCREENING OF SOME NOVEL SULPHONAMIDE QUINAZOLIN-4 (3H)-ONE …
B AHMED, A SAMAD, M HASAN - ijppsjournal.com
Transient plasmon-like modes in multi-level quantum emitter systems
MJ Gentile, WL Barnes - SPIE …
Дослідження залежності
РГ Редькін, ВП Черних, ЛА Шемчук… - Журнал органічної …
Дослідження залежності" хімічна структура-антигіпоксична дія" в ряду похідних індолу та 2-оксіндолу, які містять етиламіновий фрагмент
РГ Редькін, ВП Черних, ЛА Шемчук, НА Цубанова… -
Experimental and theoretical studies on the molecular properties of ciprofloxacin, norfloxacin, pefloxacin, sparfloxacin, and gatifloxacin in determining bioavailability
E Kłosińska-Szmurło, FA Pluciński, M Grudzień… - Journal of biological …
Anticancer ruthenium (η6-p-cymene) complexes of nonsteroidal anti-inflammatory drug derivatives
F Aman, M Hanif, WA Siddiqui, A Ashraf, LK Filak… - …
Design, synthesis and docking studies of some novel isocoumarin analogues as antimicrobial agents
Z Ashraf, A Saeed, H Nadeem - RSC Advances
Expanding on the Structural Diversity of Flavone-Derived RutheniumII (ƞ6-arene) Anticancer Agents
M Kubanik, JKY Tu, T Söhnel, M Hejl, MA Jakupec… - …
New chelating agents for Cu (II), Fe (III), Al (III), and Zn (II) based on β-diketonate-3-substituted phthalide (isobenzofuranone) and isoindolinone
L Di Matteo, O Christodoulakis, R Filosa… - Journal of …
Structural Optimization of Berberine as a Synergist to Restore Antifungal Activity of Fluconazole against Drug‐Resistant Candida albicans
H Liu, L Wang, Y Li, J Liu, M An, S Zhu, Y Cao… - …
Molecular modeling and docking studies of O-succinylbenzoate synthase of M. tuberculosis—a potential target for antituberculosis drug design
M Pulaganti, B Banaganapalli, C Mulakayala… - Applied biochemistry …
Drug design targeting protein–protein interactions (PPIs) using multiple ligand simultaneous docking (MLSD) and drug repositioning: discovery of Raloxifene and …
H Li, H Xiao, L Lin, D Jou, V Kumari… - Journal of medicinal …
IDENTIFICATION OF POTENTIAL ONCOGENE AND TRANSCRIPTION FACTOR INHIBITORS USING IN-SILICO METHODS
K Paul, P Bagchi -
Investigation of fluorinated and bifunctionalized 3-phenylchroman-4-one (isoflavanone) aromatase inhibitors
E Amato, T Bankemper, R Kidney, T Do, A Onate… - Bioorganic & medicinal …
Synthesis and Anticancer Activity of N-Aryl-5-substituted-1, 3, 4-oxadiazol-2-amine Analogues
MJ Ahsan, J Sharma, M Singh, SS Jadav… - BioMed research …
Rectification in tunneling junctions: 2, 2′-bipyridyl-terminated n-alkanethiolates
HJ Yoon, KC Liao, MR Lockett, SW Kwok… - Journal of the …
Synthesis of and Biological Study of 7-Benzyl-3-aminobenzimidazo [3, 2-a] quinolinium Chloride (ABQ-48: NSC D-763307) and 7-benzyl-3-nitrobenzimidazo [3, 2-a] …
O Cox, C Vélez, V Kumar, SV Malhotra… - Current Bioactive …
Thermal and oxidative stability of the Ocimum basilicum L. essential oil/β-cyclodextrin supramolecular system
DI Hădărugă, NG Hădărugă… - Beilstein journal of …
Synthesis, Evaluation and Docking studies of Cholecalciferol Derivative
AM Dar, A Rizvi, I Naseem - Oriental Journal of Chemistry
In silico study on Penicillin derivatives and Cephalosporins for upper respiratory tract bacterial pathogens
KM Kumar, P Anitha, V Sivasakthi, S Bag, P Lavanya… - 3 Biotech
Design, Synthesis and Bioevaluation of Novel N‐Substituted‐3, 5‐Bis (Arylidene)‐4‐piperidone Derivatives as Cytotoxic and Antitumor Agents with Fluorescent …
J Sun, S Zhang, C Yu, G Hou, X Zhang… - Chemical biology & …
Diseño basado en herramientas quimioinformáticas de agonistas del Receptor X Hepático como potenciales fármacos para el tratamiento de la Ateroesclerosis
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Binding Energy Calculation of Patchouli Alcohol Isomer Cyclooxygenase Complexes Suggested as COX-1/COX-2 Selective Inhibitor
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In silico design, synthesis, anti-inflammatory and anticancer evaluation of pyrazoline analogues of vanillin
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Estudo comparativo de raízes de Jatropha mollissima sertão/praia, das castanhas de caju (anacardium occidentale l.) de diferentes plantios e estudo in vitro e in silico …
SJM Santos -
Design, synthesis and biological evaluation of novel thiosemicarbazide analogues as potent anticonvulsant agents
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1, 3-Dipolar cycloadditions. Part-XXVIII: Selective 1, 3-dipolar cycloadditions of C-aryl-N-phenyl nitrones to arylidene acetones
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Synthesis, characterization, and biological evaluation of thiazolidine-2, 4-dione derivatives
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Design, synthesis, and biological evaluation of (e)-3, 4-dihydroxystyryl aralkyl sulfones and sulfoxides as novel multifunctional neuroprotective agents
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Prokaryotic NavMs channel as a structural and functional model for eukaryotic sodium channel antagonism
C Bagnéris, PG DeCaen, CE Naylor… - Proceedings of the …
Novel compounds lowering the cellular isoform of the human prion protein in cultured human cells
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Synthesis and pharmacological evaluation of polyfunctional benzimidazole-NSAID chimeric molecules combining anti-inflammatory, immunomodulatory and …
Y Bansal, O Silakari - Archives of pharmacal research
International Journal of Pharmaceutical Research & Analysis
B Patel Nikunj, C Patel Kaushik - ijpra.com
IN SILICO EVALUATION OF SMALL MOLECULE INHIBITORS OF 1H 1, 2, 4-TRIAZOLES AND 2, 4, 5-TRISUBSTITUTED IMIDAZOLES AGAINST 2 ABL …
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COMPARATIVE ASSESMENT OF IN VITRO AND IN VIVO BIOLOGICAL ACTIVITY OF SOME RECENTLY SYNTHESIZED AMINOPHOSPHONATES, BIS- …
M Topashka-Ancheva, B Nikolova-Mladenova… - bsphs.org
Insilico Analysis of Binding of Boeravinone E with GMCSFR and Tnfαr
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Vascular effects of diphenylmethoxypiperidine-derived dopamine uptake inhibitors
VM Pulgar, JK Harp - Bioorganic & medicinal chemistry letters
Extraction of bioactive compounds from millingtonia hortensis for the treatment of dapsone resistance in leprosy
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C. pseudotuberculosis Phop confers virulence and may be targeted by natural compounds
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Novel Tacrine Analogs as Potential Cholinesterase Inhibitors in Alzheimer's Disease
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Design, Synthesis and Evaluation of Antitubercular Activity of Mannich Bases of Isoniazid-Containing Thiazolidin-4-one Rings
B Thomas, J Harindran - Drug discovery
Optical biosensor analysis in studying new synthesized bicalutamide analogs binding to androgen receptor
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Structure modeling and hybrid virtual screening study of Alzheimer's associated protease kallikrein 8 for the identification of novel inhibitors
SS Azam, S Raza - Medicinal Chemistry Research
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A ElSawy, MS Mubarak - researchgate.net
Identification of two new phenathrenones and a saponin as antiprotozoal constituents of Drypetes gerrardii
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Alanine-rich amphiphilic peptide containing the RGD cell adhesion motif: a coating material for human fibroblast attachment and culture
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High-affinity small-molecule inhibitors of the menin-mixed lineage leukemia (MLL) interaction closely mimic a natural protein–protein interaction
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Synthesis of 1-aroyl-3, 5-dimethyl-1H-pyrazoles as anti-HCV and anticancer agents
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J Żwawiak, W Perdoc - Life Sciences
Identification of potential inhibitor targeting enoyl-acyl carrier protein reductase (InhA) in Mycobacterium tuberculosis: a computational approach
V Shanthi, K Ramanathan - 3 Biotech
Non‐natural Acetogenin Analogues as Potent Trypanosoma brucei Inhibitors
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In silico models to predict dermal absorption from complex agrochemical formulations
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SYNTHESIS, DRUGLIKENESS AND ELECTRO-OPTICAL PARAMETERS ESTIMATION OF SOME MONOTERPENIC ESTER DERIVATIVES OF …
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COMPUTATIONAL MODELING AND ANALYSIS OF THEORETICAL STRUCTURE OF CORNEODESMOSIN RECEPTOR PROTEIN WITH EXISTING …
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G Prasanthi, K Prasad, K Bharathi - European journal of medicinal …
Synthesis, crystal structure and antiproliferative activity of Cu (II) nalidixic acid–DACH conjugate: Comparative in vitro DNA/RNA binding profile, cleavage activity and …
F Arjmand, I Yousuf, T ben Hadda, L Toupet - European journal of …
Deoxyribonuclease inhibitors
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A novel green synthesis of α/β-amino acid functionalized pyrimidinone peptidomimetics using triazole ligation through click-multi-component reactions
B Balan, D Bahulayan - Tetrahedron Letters
A knowledge-based approach for identification of drugs against vivapain-2 protein of Plasmodium vivax through pharmacophore-based virtual screening with …
MK Yadav, A Singh, D Swati - Applied biochemistry and biotechnology
Expanding the scope of the crystallization-driven self-assembly of polylactide-containing polymers
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The Jmol Virtual Molecular Model Kit: A Resource for Teaching and Learning Chemistry
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Supercritical CO 2 extraction of bioactive Tyrian purple precursors from the hypobranchial gland of a marine gastropod
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A Noofeli, PJ Hall, AJR Rennie - Faraday discussions
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SYNTHESIS AND MOLECULAR MODELLING STUDIES OF SUBSTITUTED NOVEL ARYL AMIDE ANALOGUES AND EVALUATION OF THEIR …
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Synthesis of novel pyrazole–thiadiazole hybrid as potential potent and selective cyclooxygenase-2 (COX-2) inhibitors
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Studies on molecular properties prediction and histamine H 3 receptor affinities of novel ligands with uracil-based motifs
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A method for the simultaneous determination of chlorogenic acid and sesquiterpene lactone content in industrial chicory root foodstuffs
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Synthesis, characterization and preliminary anticonvulsant evaluation of some flavanone incorporated semicarbazides
CS Sharma, T Verma, HP Singh, N Kumar - Medicinal Chemistry …
Insight into the Interactions between Novel Coumarin Derivatives and Human A3 Adenosine Receptors
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Chemo-and bioinformatics resources for in silico drug discovery from medicinal plants beyond their traditional use: a critical review
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Composite fluorescent nanoparticles for biomedical imaging
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Migration of nanoparticles from plastic packaging materials containing carbon black into foodstuffs
J Bott, A Störmer, R Franz - Food Additives & Contaminants: Part A
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Estimation of Ground and Excited State Dipole Moments of aryl Boronic acid Derivative by Solvatochromic Shift Method
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Design and discovery of novel quinazolinedione-based redox modulators as therapies for pancreatic cancer
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Synthesis and Anticonvulsant Evaluation of some New 6-(Substitutedphenyl) thiazolo [3, 2-b][1, 2, 4] triazole Derivatives in Mice
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Synthesis and biological evaluation of N-dehydrodipeptidyl-N, N′-dicyclohexylurea analogs
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NOVEL MANNICH BASES OF 4-THIAZOLIDINONE DERIVATIVES AS ANTITUBERCULAR AGENTS
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Effect of cyclodextrin complexation on phenylpropanoids' solubility and antioxidant activity
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Organocatalysts of oxidative protein folding inspired by protein disulfide isomerase
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Synthesis, molecular properties and DFT studies of new phosphoramidates as potential urease inhibitors
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Synthesis, Cytotoxic Activity and 2D-QSAR Study of Some Imidazoquinazoline Derivatives
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Polyelectrolyte multilayers with perfluorinated phthalocyanine selectively entrapped inside the perfluorinated nanocompartments
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Discovery of potent anticancer agent HJC0416, an orally bioavailable small molecule inhibitor of signal transducer and activator of transcription 3 (STAT3)
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Synthesis and antiinflammatory activity of newer pyrazolinylbenzidines and isoxazolinylbenzidines
S Sharma, KK Saxena - Indian journal of pharmaceutical sciences
Biological activity and molecular docking studies of curcumin-related α, β-unsaturated carbonyl-based synthetic compounds as anticancer agents and mushroom …
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Synthesis and Cytotoxicity evaluation of small 1, 4-triazolic derivatives against B16 melanoma cell lines and a methodolgy study on the synthesis of propargyl ethers …
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Synthesis and evaluation of octocrylene-inspired compounds for UV-filter activity
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Insilico study of anti-carcinogenic lysyl oxidase-like 2 inhibitors
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EXPLORING THE POSSIBLE MECHANISM OF ALBIZZIA LEBBECK COMPONENTS BINDING WITH DRUG TARGETS OF BRONCHIAL ASTHMA–AN …
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Synthesis and pharmacological evaluation of 5-pyrrolidinylquinoxalines as a novel class of peripherally restricted κ-opioid receptor agonists
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Antiallergic activity of various kinds of vegetables and fruits in Japan and Thailand
A Sato, V Surojanametakul, T Zhang… - Journal of Science …
Synthesis and evaluation of chalcone derivatives as inhibitors of neutrophils' chemotaxis, phagocytosis and production of reactive oxygen species
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Yeast synthetic biology platform generates novel chemical structures as scaffolds for drug discovery
J Klein, JR Heal, WDO Hamilton… - ACS synthetic …
Methylenedioxy flavonoids: assessment of cytotoxic and anti-cancer potential in human leukemia cells
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Replacement of amide with bioisosteres led to a new series of potent adenosine A 2A receptor antagonists
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Screening and identification of neuroprotective compounds relevant to Alzheimer׳ s disease from medicinal plants of S. Tomé e Príncipe
A Currais, C Chiruta, M Goujon-Svrzic, G Costa… - Journal of …
Celecoxib analogs bearing benzofuran moiety as cyclooxygenase-2 inhibitors: design, synthesis and evaluation as potential anti-inflammatory agents
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BioPhytMol: a drug discovery community resource on anti-mycobacterial phytomolecules and plant extracts
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Synthesis, pharmacological study and docking calculations of new benzo [f] coumarin derivatives as dual inhibitors of enzymatic systems involved in …
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Design, synthesis, and PASS-assisted evaluation of novel 2-substituted benzimidazole derivatives as potent anthelmintics
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2, 4-Dialkyl-8, 9, 10, 11-tetrahydrobenzo [g] pyrimido [4, 5-c] isoquinoline-1, 3, 7, 12 (2H, 4H)-tetraones as new leads against Mycobacterium tuberculosis
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AlzPlatform: an Alzheimer's disease domain-specific chemogenomics knowledgebase for polypharmacology and target identification research
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Synthesis and Cytotoxicity evaluation of small 1, 4-triazolic derivatives against B16 melanoma cell lines and a methodolgy study on the synthesis of propargyl ethers …
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Design, synthesis and biological evaluation of (E)-2-(2-arylhydrazinyl) quinoxalines, a promising and potent new class of anticancer agents
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Novel tuberculostatic agents suitable for treatment of Mycobacterium tuberculosis infections of the central nervous system
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Benzofuran–Morpholinomethyl–Pyrazoline Hybrids as a New Class of Vasorelaxant Agents: Synthesis and Quantitative Structure–Activity Relationship Study
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Metabolism of RCS-8, a synthetic cannabinoid with cyclohexyl structure, in human hepatocytes by high-resolution MS
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Computer-assisted design of novel 1, 4-dihydropyridine calcium channel blockers
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Metabolite elucidation of the Hsp90 inhibitor SNX-2112 using ultraperformance liquid chromatography/quadrupole time-of-flight mass spectrometry (UPLC-QTOF/MS)
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Synthesis And Druglikeness Estimation Of Amide Derivatives Of 1-Benzyltheobromine-8-Thioglycolic Acid
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Physiologically based pharmacokinetic modeling of POPs in Greenlanders
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QSAR, docking, dynamic simulation and quantum mechanics studies to explore the recognition properties of cholinesterase binding sites
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Design, synthesis, acetylcholinesterase inhibition and larvicidal activity of girgensohnine analogs on Aedes aegypti, vector of dengue fever
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2-Aminothiazole derivatives as antimycobacterial agents: Synthesis, characterization, in vitro and in silico studies
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Chemoinformatics approach for the design and screening of focused virtual libraries
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EGFRIndb: epidermal growth factor receptor inhibitor database
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Novel coumarin–benzimidazole derivatives as antioxidants and safer anti-inflammatory agents
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Synthesis and molecular modeling studies of novel tert-butyl 2, 4-disubstituted carboxamido phenylcarbamate derivatives and evaluation of their antimicrobial …
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Design and development of oxazol-5-ones as potential partial PPAR-γ agonist against cancer cell lines
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A development of chimeric VEGFR2 TK inhibitor based on two ligand conformers from PDB: 1Y6A complex–Medicinal chemistry consequences of a TKs analysis
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Advances in algal drug research with emphasis on enzyme inhibitors
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NMR screening of potential inhibitors of methionine γ-lyase from Citrobacter freundii
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Design, synthesis, and characterization of novel apigenin analogues that suppress pancreatic stellate cell proliferation in vitro and associated pancreatic fibrosis in …
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New class of methyl tetrazole based hybrid of (Z)-5-benzylidene-2-(piperazin-1-yl) thiazol-4 (% H)-one as potent antitubercular agents
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Design, an efficient ecofriendly synthesis of spirooxindole derivatives and their anticancer activity supported by molecular docking studies
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Radiolabeled Pyridopyrazinone Derivatives for PET Imaging of Phosphodiesterase-5A (PDE5A)
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Studies on the anticonvulsant activity and influence on GABA-ergic neurotransmission of 1, 2, 4-triazole-3-thione-based compounds
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A spectroscopic investigation and molecular docking study on the interaction of hen egg white lysozyme with liposomes of saturated and unsaturated …
A Das, R Thakur, A Dagar… - Physical Chemistry …
Insights into Substrate and Metal Binding from the Crystal Structure of Cyanobacterial Aldehyde Deformylating Oxygenase with Substrate Bound
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68 Ga based probe for Alzheimer's disease: synthesis and preclinical evaluation of homodimeric chalcone in β-amyloid imaging
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Percutaneous absorption of herbicides derived from 2, 4-dichlorophenoxyacid: Structure–activity relationship
D Beydon, JP Payan, E Ferrari, MC Grandclaude - Toxicology in Vitro
Determination and prediction of the lag times of hydrocarbons through a polyethylene terephthalate film
J Ewender, F Welle - Packaging Technology and Science
Cyclotide structure–activity relationships: qualitative and quantitative approaches linking cytotoxic and anthelmintic activity to the clustering of …
S Park, AA Strömstedt, U Göransson - PloS one
Journal of Taibah University Medical Sciences
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Preliminary screening of biological activities of some new Schiff bases of isatins
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SÍNTESIS Y CARACTERIZACIÓN DE UN NUEVO DERIVADO DE LA PODOFILOTOXINA
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EFFECT OF COMPUTATIONALLY SYNTHESIZED PROBABLE DRUGS ON BETA TOXIN OF CLOSTRIDIUM PERFRINGENS
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DESIGN, AN EFFICIENT ECOFRIENDLY SYNTHESIS OF SPIROOXINDOLE DERIVATIVES AND THEIR ANTICANCER ACTIVITY SUPPORTED BY …
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Synthesis and molecular docking study of N-alkyl/aryl-2-aryl indol-3-yl glyoxylamides as novel anticancer agents
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Synthesis, crystal studies, anti-tuberculosis and cytotoxic studies of 1-[(2E)-3-phenylprop-2-enoyl]-1H-benzimidazole derivatives
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Rational design, synthesis and evaluation of chromone-indole and chromone-pyrazole based conjugates: Identification of a lead for anti-inflammatory drug
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Synthesis and antiproliferative activity of 8-hydroxyquinoline derivatives containing a 1, 2, 3-triazole moiety
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Mass Spectrometry Based Quantification of 1, 3-Butadiene Induced DNA Adducts: Potential Biomarkers of Cancer Risk
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Evaluation of PET radioligands for in vivo visualization of phosphodiesterase 5 (PDE5)
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Newcastle University ePrints
SA Holt, AP Le Brun, ARJ Nelson, JH Lakey - eprint.ncl.ac.uk
Synthesis, characterization and pharmacological evaluation of certain sulfonamide containing heterocyclic motifs
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Novel macrocyclic molecules based on 12a-N substituted 16-membered azalides and azalactams as potential antifungal agents
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Synthesis, anticancer evaluation and docking study of vadimezan derivatives with carboxyl substitution
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The antihypersensitive and antiinflammatory activities of a benzofuranone derivative in different experimental models in mice: the importance of the protein kinase C …
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Semisynthesis, ex vivo evaluation, and SAR studies of coumarin derivatives as potential antiasthmatic drugs
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Дослідження взаємодії солей тіосульфокислот з 2, 3-дихлор-1, 4-нафтохіноном
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Absorption, metabolism and effect of compatibility on absorption of qishenyiqi dropping pill
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Polyfluorinated bis-styrylbenzenes as amyloid-β plaque binding ligands
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Design and Synthesis of C3‐Pyrazole/Chalcone‐Linked Beta‐Carboline Hybrids: Antitopoisomerase I, DNA‐Interactive, and Apoptosis‐Inducing Anticancer Agents
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Busca In Silico de Inibidores de Fosfolipase A2 de Apis mellifera com validação In Vitro e In Vivo
DMM Jorge - teses.usp.br
Retention time prediction for dereplication of natural products (CxHyOz) in LC–MS metabolite profiling
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НН Пшенкина, ГА Софронов - reanimatology.com
Physico-chemical properties of lomefloxacin, levofloxacin and moxifloxacin relevant to Biopharmaceutics Classification System
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Novel quinazoline and pyrido [2, 3-d] pyrimidine derivatives and their hydroselenite salts as antitumoral agents
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Synthesis and Antitubercular Screening of [(2‐Chloroquinolin‐3‐yl) methyl] Thiocarbamide Derivatives
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Ultrasound‐Assisted Synthesis, Anticonvulsant Activity, and Docking Study of Indole‐Appended Thiazolidin‐4‐ones
APG Nikalje, SI Shaikh, A Mulay, FAK Khan… - Archiv der …
Optimizacija Strukturno Odvisnih Parametrov Pri Sklopljeni Masni Spektrometriji Za Izbrane Sintezne Kanabinoide Ter Njihova Modulacija Ionskih Kanalov
I Hari -
Blood Schizontocidal and Gametocytocidal Activity of 3-Hydroxy-N′-arylidenepropanehydrazonamides: A New Class of Antiplasmodial Compounds
M Leven, J Held, S Duffy, S Tschan, S Sax… - Journal of medicinal …
Discovering Echinococcus granulosus thioredoxin glutathione reductase inhibitors through site-specific dynamic combinatorial chemistry
C Saiz, V Castillo, P Fontán, M Bonilla, G Salinas… - Molecular …
Molecular neuroimaging of Alzheimer's disease
RJA Nabuurs -
" Drug Design" et synthèse de nouveaux calix [8] arènes sulfoniques flexibles à activités anticorrosive et anticoagulante
MR Seifeddine -
Promising near-infrared non-targeted probes: benzothiazole heptamethine cyanine dyes
OA Okoh, RH Bisby, CL Lawrence… - Journal of Sulfur …
Interactions of chitosan/genipin hydrogels during drug delivery: a QSPR approach
NL Delgadillo-Armendariz, NA Rangel-Vazquez… - Química …
Nubbe natural products, source of molecular diversity for the design of new anticancer agents
M Valli -
Investigating the interactions of the 18kDa translocator protein and its ligand PK11195 in planar lipid bilayers
CR Hatty, AP Le Brun, V Lake, LA Clifton, GJ Liu… - … et Biophysica Acta (BBA …
Investigation of a Novel Series of 2-Hydroxyisoquinoline-1, 3 (2 H, 4 H)-diones as Human Immunodeficiency Virus Type 1 Integrase Inhibitors
V Suchaud, F Bailly, C Lion, C Calmels… - Journal of medicinal …
A comparative study of the molecular structure, lipophilicity, solubility, acidity, absorption and polar surface area of coumarinic anticoagulants and direct thrombin …
M Remko, R Broer, A Remková - RSC Advances
Synthesis of β-carboline–benzimidazole conjugates using lanthanum nitrate as a catalyst and their biological evaluation
A Kamal, MPN Rao, P Swapna, V Srinivasulu… - Organic & …
Xanthenedione derivatives, new promising antioxidant and acetylcholinesterase inhibitor agents
AML Seca, SB Leal, DCGA Pinto, MC Barreto, A Silva - Molecules
Targeting NAD+ metabolism in the human malaria parasite Plasmodium falciparum
JK O'Hara, LJ Kerwin, SA Cobbold, J Tai, TA Bedell… - PloS one
A physiologically based pharmacokinetic model of alvespimycin in mice and extrapolation to rats and humans
ZY Hu, J Lu, Y Zhao - British journal of pharmacology
Absorbability, Mechanism and Structure-Property Relationship of Three Phenolic Acids from the Flowers of Trollius chinensis
XW Wu, RF Wang, LJ Liu, LN Guo, C Zhao - Molecules
Structure–activity relationships of β-hydroxyphosphonate nucleoside analogues as cytosolic 5′-nucleotidase II potential inhibitors: Synthesis, in vitro evaluation and …
M Meurillon, Z Marton, A Hospital, LP Jordheim… - European journal of …
Predictive in silico off-target profiling in drug discovery
F Schmidt, H Matter, G Hessler… - Future medicinal …
3-Hydroxy-4-pyridinone derivatives as metal ion and amyloid binding agents
MA Telpoukhovskaia, C Rodríguez-Rodríguez… - Metallomics
Biomedical Applications of Emulsion Templated Scaffolds
RS Moglia -
Microwave assisted synthesis of naphthopyrans catalysed by silica supported fluoroboric acid as a new class of non purine xanthine oxidase inhibitors
S Sharma, K Sharma, R Ojha, D Kumar, G Singh… - Bioorganic & medicinal …
Lead modification: Amino acid appended indoles as highly effective 5-LOX inhibitors
P Prasher, P Singh - Bioorganic & medicinal chemistry
INSILCO STUDIES ON MEMBRANE RECEPTORS OF TYPE 2 DIABETES MILLETUS
P Tiruveedhula, AP Muttagi, K Paul -
Development of 1, 3 Benzothiazol-2-yl Hydrazine Derivatives Containing Semicarbazone and Thioamide Pharmacophore as Anticonvulsants
R Ali, N Siddiqui - Letters in Drug Design & Discovery
Synthesis and antiproliferative activity of novel methylselenocarbamates
B Romano, M Font, I Encío, JA Palop… - European journal of …
Euphorbia and Momordica metabolites for overcoming multidrug resistance
MJU Ferreira, N Duarte, M Reis, AM Madureira… - Phytochemistry …
Cloud computing infrastructure development for chemoinformatics
M Karthikeyan, R Vyas - Practical Chemoinformatics
Nanoengineered CdSe quantum dot–montmorillonite composites: an efficient photocatalyst under visible light irradiation
RC Chikate, BS Kadu, MA Damle - RSC Advances
A method to predict blood-brain barrier permeability of drug-like compounds using molecular dynamics simulations
TS Carpenter, DA Kirshner, EY Lau, SE Wong… - Biophysical journal
Molecular Structure and Identification Through G-SIMS and SMILES
FM Green, IS Gilmore, MP Seah - Surface Analysis and Techniques in …
Structure-based virtual screening of novel, high-affinity BRD4 inhibitors
C Muvva, ERA Singam, SS Raman… - Molecular …
Hemi-synthesis of three new armed antibiotics analogs of Calcimycin (A23187) and determination of theirs acidity constants by potentiometric method
M Mimouni, A Melhaoui, I El Mounsi, YN Mabkhot… - jmaterenvironsci.com
Structureeactivity relationships of b-hydroxyphosphonate nucleoside analogues as cytosolic 5 0-nucleotidase II potential inhibitors: Synthesis, in vitro evaluation …
J Béjaud, C Lionne, C Dumontet… - European Journal of …
Polymorphism and isomorphism of Huperzine A solvates: structure, properties and form transformation
Q Zhang, L Lu, W Dai, X Mei - CrystEngComm
Cycloartanes with Anticancer Activity Demonstrate Promising inhibition of the Mrck [alpha] and Mrck [beta] Kinases
HIC Lowe, NJ Toyang, CT Watson… - British Journal of …
Planejamento computacional de compostos anti-HIV-1 com múltiplos alvos
MC Guimarães -
Escherichia coli kduD encodes an oxidoreductase that converts both sugar and steroid substrates
A Tubeleviciute, MG Teese, J Jose - Applied microbiology and …
Development of amino acid conjugated sulfonamides as potent antiulcer agent
SP Sahoo, BB Subudhi - Medicinal Chemistry Research
Design, economical synthesis and antiplasmodial evaluation of vanillin derived allylated chalcones and their marked synergism with artemisinin against chloroquine …
N Sharma, D Mohanakrishnan, UK Sharma… - European journal of …
DESIGN, NOVEL SYNTHESIS AND DOCKINGSTUDIES OF N, N'-SUBSTITUTED UREA ANALOGUES AND EVALUATION OF THEIR ANTIMICROBIAL …
J Pochampally, A Valeru, B Shankar, D Mandala… -
ESTUDO DE CHALCONAS COMO ANTIBACTERIANOS POTENCIAIS: SÍNTESE, AVALIAÇÃO DA AÇÃO ANTIBACTERIANA E DAS PROPRIEDADES FÍSICO- …
PA Mariño - cursos.unipampa.edu.br
Design, synthesis and evaluation of 2-aminothiazole derivatives as sphingosine kinase inhibitors
D Vogt, J Weber, K Ihlefeld, A Brüggerhoff… - Bioorganic & medicinal …
4, 6‐Diaryl/heteroarylpyrimidin‐2 (1H)‐ones as a New Class of Xanthine Oxidase Inhibitors
S Shukla, D Kumar, R Ojha, MK Gupta… - Archiv der …
A fluorescent probe for estimation of adenosine diphosphate and monitoring of glucose metabolism
A Kumar, P Prasher, P Singh - Organic & biomolecular chemistry
Polymersomes as a potential tool in nuclear medicine
G Wang -
Practical Chemoinformatics
M Karthikeyan, R Vyas -
The gating of the bacterial mechanosensitive channel MscS reflects its function as a sensor of both crowding and lateral pressure as well as its role in osmoregulation
ID Rowe -
Multimethodological study of molecular recognition phenomena
C Fortugno -
Design, synthesis and biological evaluation of novel 4-alkapolyenylpyrrolo [1, 2-a] quinoxalines as antileishmanial agents–Part III
L Ronga, M Del Favero, A Cohen, C Soum… - European journal of …
ANTI-EGF/EGFR THERAPEUTIC ANTI-CANCER DRUGS AND THE WOUND HEALING PROCESS
AOFPMBY LENTIVIRAL, MOFES CELL -
Design, Synthesis, and Antimicrobial Evaluation of Hexadentate Hydroxypyridinones with High Iron (III) Affinity
MX Zhang, CF Zhu, YJ Zhou, XL Kong… - Chemical biology & …
Mechanistic insights in glycation-induced protein aggregation
M Adrover, L Mariño, P Sanchis, K Pauwels… - …
Synthesis and evaluation of the cytotoxic activity of 1, 2-furanonaphthoquinones tethered to 1, 2, 3-1H-triazoles in myeloid and lymphoid leukemia cell lines
MFC Cardoso, PC Rodrigues, MEIM Oliveira… - European journal of …
Turning Around the L‐Phe‐D‐Oxd Moiety for a Versatile Low‐Molecular‐Weight Gelator
L Milli, N Castellucci, C Tomasini - European Journal of …
Comparative evaluation of in silico and in vitro pharmacological activity of some 5-nitrosalicylaldehyde-derived hydrazones
B Nikolova-Mladenova, G Momekov, T Gerasimova… - bioscience.scientific-journal.com
Structure and evaluation of antibacterial and antitubercular properties of new basic and heterocyclic 3-formylrifamycin SV derivatives obtained via 'click chemistry' …
K Pyta, K Klich, J Domagalska, P Przybylski - European journal of medicinal …
Synthesis, characterization, and biological evaluation of some novel thiosemicarbazones as possible antibacterial and antioxidant agents
A Karaküçük-İyidoğan, Z Mercan… - … , Sulfur, and Silicon …
Triagem biológica, identificação e planejamento de novos candidatos a agentes anticâncer a partir de produtos naturais e compostos sintéticos
WF Altei - teses.usp.br
Synthesis of bio-based nanocomposites for controlled release of antimicrobial agents in food packaging
ML DeGruson -
Dendrimer space exploration: an assessment of dendrimers/dendritic scaffolding as inhibitors of protein–protein interactions, a potential new area of pharmaceutical …
S Mignani, S El Kazzouli, MM Bousmina, JP Majoral - Chem. Rev
Modelagem Mia-Qsar das atividades biológicas de inibidores de fosfodiesterase tipo-5
JE Antunes -
ToxiPred: A server for prediction of aqueous toxicity of small chemical molecules in T. Pyriformis
NK Mishra, D Singla, S Agarwal… - Journal of …
Analysis of the Structural Diversity, Substitution Patterns, and Frequency of Nitrogen Heterocycles among US FDA Approved Pharmaceuticals: Miniperspective
E Vitaku, DT Smith, JT Njardarson - Journal of medicinal chemistry
Open-Source Tools, Techniques, and Data in Chemoinformatics
M Karthikeyan, R Vyas - Practical Chemoinformatics
Modelo Dinámico para Estimar la Distribución y Persistencia de Microcistina–LR en una Cuenca Urbana
LA Kieffer -
Synthesis, Characterisation of β-indolylketones and the Effect of Lipophilicity on the Antimicrobial Activity
YLN Murthy, P Choppara, YV Prasad… - Current …
A review on principles, theory and practices of 2D-QSAR
K Roy, R Narayan Das - Current drug metabolism
Self-assembly of selected amphiphilic calix [4] arenes and calix [6] arenes in solid state-single crystal x-ray diffraction studies
A Shkurenko -
Vers de nouveaux antalgiques: optimisation de molécules activatrices des canaux potassiques TREK-1
D Vivier -
Studying single-chain polymeric nanoparticle catalyzed oxidation reactions
ERJ Souren - alexandria.tue.nl
Metodologias em educação ambiental formal e não formal para a conservação do sistema sócio-ecológico
MR Freitas -
Effects of Antihistamines on the Function of Human Alpha-7 Nicotinic Acetylcholine Receptors.
SS Khanian -
Syntheses and Antimycobacterial Activities of [(2S, 3R)-2-(Amino)-4-(Arenesulfonamido)-3-Hydroxy-1-Phenylbutane Derivatives
M Moreth, C RB Gomes, M CS Lourenco… - Medicinal …
Synthesis and Anticonvulsant Activity of N-(trans)-3-phenylprop-2-en-1-yl (Cinnamyl) Derivatives of Aminoalkanols
A Gunia-Krzyzak, AM Waszkielewicz… - Letters in Drug …
Structure-Based Drug Design and Synthesis of Anti-infective and Anticancer Agents
N Gummudipundi Dayanandan -
Effect of 2-Methyl furan on sperm head morphology of mouse
R Prabha - International E-Publication - isca.co.in
TOX-10 Hesperetin Attenuates Cisplatin Induced Nephrotoxicity via Modulation of Oxidative Stress and Renal Inflammation in Male Wistar Rats
ER Kasala, V Dahiya, L Narendra… - Indian Journal of …
Novel multifunctional ligands and their application in Alzheimer's disease
MA Telpoukhovskaia -
Poster Papers
A Tejus, AK Sharma, N Dahiya - Indian Journal of Pharmacology
Diblock copolymer stabilized nanoparticles for drug delivery via flash nanoprecipitation
J Han -
ИЗУЧЕНИЕ ФЕНОТИПА ЛИМФОЦИТОВ ПОСЛЕ ИММУНОТЕРАПИИ БОЛЬНЫХ РАКОМ ЖЕЛУДКА И ТОЛСТОГО КИШЕЧНИКА
ЕВ Абакушина, ЮВ Маризина, ГС Неприна… - cyberleninka.ru
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