Structure-Activity-Relationship Study
A Quantitative Structure Activity Relationship Study on a Indo 2 yl Derivatives as Anti HCV agents
... to the ring is detrimental to it. The reason for the positive effect of it due to the absence of hydrogen bond interaction between sulphur and the receptor. On the other hand substitution of difluoromethoxy at 6-position ...
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Quantitative Structure Activity Relationship Study of Naphthoquinone Analogs as Possible DNA Topoisomerase Inhibitors
... biological activity within a congeneric sequence with certain structural parameters or with functional determinants, such as lipophilicity, polarizability, or electronic and steric properties ...between ...
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Quantitative structure activity relationship study of parasubstituted trans and cis tamoxifen derivatives
... crystal structure of the 4-hydroxytamoxifen (4OHT) bound to the human estrogen receptor alpha (hER α ) ligand-binding domain (LBD) retrieved from the Protein Data Bank (PDB ID code ...
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Structure-Activity Relationship Study on 2-Aminoimidazole Derivatives: From Model Studies to Biological Activity Augmentation.
... anti-biofilm activity and the commonly shared 2-AI motif was identified as the key ...their activity at micromolar concentrations against both Gram-positive and Gram-negative ...the relationship ...
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Quantitative Structure Activity Relationship Study of Some Antipsychotics by Multiple Linear Regressions
... The objectives of this work were to investigate the retention behavior of this kind of compound using reversed-phase thin-layer chromatography, to determine their lipophilicity, to inves[r] ...
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IN-SILICO STRUCTURE-ACTIVITY RELATIONSHIP AND MOLECULAR DOCKING STUDY OF NEROLIDOL AND ITS MODIFIED ANALOGUE AGAINST THE TRYPANOSOMA BRUCEI HEXOKINASE
... docking study was carried out on nerolidol and its modified analogue against Trypanosoma brucei hexokinase using the Autodock Vina ...Extensive structure activity relationship study was ...
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IN-SILICO STRUCTURE-ACTIVITY RELATIONSHIP AND MOLECULAR DOCKING STUDY OF LEVOFLOXACIN AND ITS MONO SUBSTITUTED ANALOGUES AGAINST THE ESCHERICHIA COLI AMINOGLYCOSIDE PHOSPHOTRANSFERASE
... bactericidal activity, aminoglycosides were one of the first groups of antibiotics to meet the challenge of ...Extensive structure activity relationship study was carried out with ...
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The role of lipid droplet formation in the protection of unsaturated fatty acids against palmitic acid induced lipotoxicity to rat insulin-producing cells
... present structure-activity-relationship study the correlation between lipid droplet formation and the protection against palmitic acid induced lipotoxicity by unsaturated NEFAs in rat ...
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IN VITRO EVALUATION OF ANTIOXIDANT AND ANTIMICROBIAL ACTIVITY OF SERIES OF NEW PYRAZOLE DERIVATIVES; A STUDY ON THE STRUCTURE ACTIVITY RELATIONSHIP
... The term ‘antioxidant’ refers to the activity of numerous vitamins, minerals and phytochemicals which provide protection against the damage caused by ROS 2 . Antioxidants interfere with the oxidative processes by ...
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Molecular modeling of 4-fluoropyrrolidine-2-carbonitrile and octahydrocyclopenta[b]pyrrole-2-carbonitrile as a dipeptidyl peptidase IV (DPP4) inhibitor
... QSAR study was performed to reveal structure– activity relationship of β-amino pyrrolo-2-carbonitrile as a DPP4 ...present study, only S22 was removed, while compound S24 was kept in ...
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Application of QSAR Methods on the Study of Bioactive Molecules Derived from Isatin
... A study of quantitative structure-activity relationship (QSAR) is applied to a set of 47 molecules derived from isatin, in order to predict the anticancer biological activity of the ...
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Biological activity, quantitative structure–activity relationship analysis, and molecular docking of xanthone derivatives as anticancer drugs
... this study, a series of xanthone derivatives were studied as cytotoxic agents against the WiDR cell line (colorectal ...QSAR study revealed that the descriptors of the net atomic charges at qC1, qC2, and ...
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Validation Method Used In Quantitative Structure Activity Relationship
... Quantitative structure activity relationship is study of relationship between physiochemical (independent) properties and biological (dependent) activity of bioactive ...the ...
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Structure- Activity Relationship (Sar) Of Cyanoethylated Aromatic Amines
... The dyes obtained by coupling Azodin A or Azodin B to diaotized diazo components are listed in Fig. 1. From the results shown in Table 1, the dyes obtained from Azodin B (dye 1,2,3,4,5,7 and 8) absorbed in the range 390 ...
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Computation of Structure Activity and Design of Chalcone Derivatives
... There are many chalcone derivatives and these derivatives have long research and development cycle. In order to reduce the time of the research and devel- opment, the QSAR was used to study the relationship ...
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3D QSAR OF N SUBSTITUTED IMIDAZOLES AS ANTIFUNGAL AGENTS
... antifungal activity by three-dimensional quantitative structure-activity relationship (3D- QSAR) using comparative molecular field analysis ...this study, the superimposition of ...
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A univariate analysis of molecular properties and inhibitory activity of dihydrothiophenones against dihydroorotate dehydrogenase of malaria parasite
... the relationship between the properties of these compounds and the observed antimalarial ...Quantitative Structure-Activity Relationship (QSAR) study was carried out on ...
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QSAR, Molecular Docking and Dynamics Studies of Quinazoline Derivatives as Inhibitor of Phosphatidylinositol 3-Kinase
... current study, thirty-one quinazoline derivatives were utilized to build a Quantitative Structure-Activity Relationship (QSAR) model which correlates structural feature with PI3K ...
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SYNTHESIS OF N'-(CHLOROACETYL)NAPHTHO[2,1-B]FURAN-2- CARBOHYDRAZIDE AND N'-(ARYLAMINOACETYL)NAPHTHO [2,1-B]FURAN-2-CARBOHYDRAZIDE DERIVATIVES AND THEIR ANTIMICROBIAL ACTIVITIES
... 10.81 (two, s, 2NH). MS m/z: 302 (M+), 304 (M+2). The selection of aromatic amines was based on electron withdrawing and electron donating groups/ which could enable to study structure activity ...
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A Comparative Study of Molecular Structure, Vibrational Analyses and Non Linear Optical Properties of Two Positional Isomers of Chlorothiophene-2-carboxylic Acid using Quantum Chemical Method
... present study on 3-chlorothiophene- 2-carboxylic acid and 5-chlorothiophene- 2- carboxylic acid, comprised of equilibrium geometries optimization and the calculation of molecular ground state properties at ...
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