Use of Quantitative Structure–Activity Relationship (QSAR) and ADMET prediction studies as screening methods for design of benzyl urea derivatives for anti-cancer …

D Lokwani, S Bhandari, R Pujari, P Shastri…

Index: Lokwani, Deepak; Bhandari, Shashikant; Pujari, Radha; Shastri, Padma; Shelke, Ganesh; Pawar, Vidya Journal of Enzyme Inhibition and Medicinal Chemistry, 2011 , vol. 26, # 3 p. 319 - 331

Full Text: HTML

Citation Number: 5

Abstract

2D and 3D quantitative structure–activity relationship studies have been carried out for establishing a correlation between the structural properties of benzyl urea derivatives and their anti-tumour activities. From this correlation, the new chemical entities were designed, and their activity and absorption, distribution, metabolism, excretion, and toxicity properties were also predicted. Finally, the most promising compounds from these screening were ...

Related Articles:

Synthesis of heterocyclic compounds by ring-closing metathesis (RCM): preparation of oxygenated or nitrogenated compounds

[Sanchez, Isabel; Pujol, Maria Dolors Synthesis, 2006 , # 11 p. 1823 - 1828]

Amination of Alcohols Catalyzed by Copper??Aluminium Hydrotalcite: A Green Synthesis of Amines

[Likhar, Pravin R.; Arundhathi, Racha; Kantam, Mannepalli Lakshmi; Prathima, Parvathaneni Sai European Journal of Organic Chemistry, 2009 , # 31 p. 5383 - 5389]

An Improved Process for the Synthesis and Isolation of (S)-N-(1-Phenylethyl) hydroxylamine

[Coskun, Necdet; Parlar, Aydin Synthetic Communications, 2005 , vol. 35, # 18 p. 2445 - 2451]

More Articles...