Results 161 to 170 of about 1,944,029 (193)
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Prediction of Atropisomerism for Drug-like Molecules
Journal of Chemical Information and ModelingA multistep computational workflow that accurately assigns organic drug-like molecules to one of three atropisomer classes on the basis of computed barrier heights has been developed. The workflow identifies rotatable bonds and applies progressively more accurate types of calculations to the eligible rotational degrees of freedom.
Ty Balduf +7 more
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How drug-like are ‘ugly’ drugs: do drug-likeness metrics predict ADME behaviour in humans?
Drug Discovery Today, 2014Using a published drug-likeness score based on the calculated physicochemical properties of marketed oral drugs (quantitative estimate of drug-likeness, QED) and published human data, high-scoring and low-scoring drugs were compared to determine how well the score correlated with their actual pharmaceutical and pharmacokinetic (PK) profiles in humans ...
Timothy J, Ritchie, Simon J F, Macdonald
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TRPs: Modulation by Drug-Like Compounds
2014Drug-like compounds that exert biological activity towards TRP channels are either being used as cell biological tools or further developed into pharmacological lead structures aiming at therapeutic use in diseased states. Although drug-likeliness is not easy to predict, common rules include a relatively low molecular weight, physicochemical ...
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Drug-Like Property Concepts in Pharmaceutical Design
Current Pharmaceutical Design, 2009The pharmaceutical industry is facing an ever increasing challenge to deliver safer and more effective medicines. Traditionally, drug discovery programs were driven solely by potency, regardless of the properties. As a result, the development of non-drug-like molecules was costly, had high risk and low success rate.
Li, Di, Edward H, Kerns, Guy T, Carter
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Skin Occlusion: Treatment or Drug-Like Device?
Skin Pharmacology, 2009The effects of occlusion on skin function are described and reviewed. Occlusion seems to be not only a device applied on the skin surface, but, under certain conditions, a powerful treatment capable of inducing several changes on epidermal metabolism, skin flora, sweat glands and epidermal morphology.
E, Berardesca, H I, Maibach
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Lipid‐Bilayer Permeation of Drug‐Like Compounds
Chemistry & Biodiversity, 2009AbstractLipid‐bilayer permeation is determinant for the disposition of xenobiotics in the body. It controls the pharmacokinetic behavior of drugs and is, in many cases, a prerequisite for intracellular targeting. Permeation ofin vivobarriers is in general predicted from lipophilicity and related parameters.
Stefanie D, Krämer +4 more
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ChemInform, 2001
AbstractChemInform is a weekly Abstracting Service, delivering concise information at a glance that was extracted from about 100 leading journals. To access a ChemInform Abstract of an article which was published elsewhere, please select a “Full Text” option. The original article is trackable via the “References” option.
Jun Xu, James Stevenson
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AbstractChemInform is a weekly Abstracting Service, delivering concise information at a glance that was extracted from about 100 leading journals. To access a ChemInform Abstract of an article which was published elsewhere, please select a “Full Text” option. The original article is trackable via the “References” option.
Jun Xu, James Stevenson
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STEROIDAL THIOSEMICARBAZONES: DRUG-LIKENESS AND ANTIOXIDANT PROPERTIES
XXX Savetovanje o biotehnologiji sa međunarodnim učešćemThiosemicarbazones (TSCs) are well known for their diverse biological activities and wide-ranging applications. This study assessed the drug- likeness and antioxidant potential of previously synthesized steroidal TSCs with promising cytotoxicity. While all tested androstane TSCs are drug-like, they have poor water solubility, strong plasma protein ...
Živković, Marijana +4 more
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Antibody–Drug Conjugates: Smart Chemotherapy Delivery Across Tumor Histologies
Ca-A Cancer Journal for Clinicians, 2022Shanu Modi +2 more
exaly
Two antiretroviral drugs likely to be confused
American Journal of Health-System Pharmacy, 1998J T, Johnson, E B, Dunn, J J, Wolfe
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