Quantum chemical quantitative structure activity studies of anticancer activity of Aldohexose chloroethylnitrosourea Analogs

Quantitative structure activity relationship involving 18 aldohexose chloroethylnitrosourea compounds having anticancer activity against Ip-Implanted Murine L1210 Lymphoid Leukemia, is investigated using semi-empirical quantum chemical AM1 methods. Quantum chemical methods are used to calculate...

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Main Authors:	Noorbatcha, Ibrahim Ali, Syed Osman Idid, Syed Zahir Idid, Eissa, Maimonah
Format:	Conference or Workshop Item
Language:	English
Published:	2010
Subjects:	TP248.13 Biotechnology
Online Access:	http://irep.iium.edu.my/4099/ http://irep.iium.edu.my/4099/ http://irep.iium.edu.my/4099/4/ICAST2010_QSAR_%282%29.pdf

id	iium-4099
recordtype	eprints
spelling	iium-40992011-11-21T19:48:30Z http://irep.iium.edu.my/4099/ Quantum chemical quantitative structure activity studies of anticancer activity of Aldohexose chloroethylnitrosourea Analogs Noorbatcha, Ibrahim Ali Syed Osman Idid, Syed Zahir Idid Eissa, Maimonah TP248.13 Biotechnology Quantitative structure activity relationship involving 18 aldohexose chloroethylnitrosourea compounds having anticancer activity against Ip-Implanted Murine L1210 Lymphoid Leukemia, is investigated using semi-empirical quantum chemical AM1 methods. Quantum chemical methods are used to calculate several electronic and molecular properties of these compounds and these properties are used to obtain the best QSAR using statistical procedures. A best QSAR with correlation coefficient of R2 = 0.7270 is established with four theoretical molecular descriptors. The QSAR obtained in our study can be used to predict the anticancer activity of new aldohexose chloroethylnitrosourea analogs, without resorting to any experimental studies. 2010-11-26 Conference or Workshop Item NonPeerReviewed application/pdf en http://irep.iium.edu.my/4099/4/ICAST2010_QSAR_%282%29.pdf Noorbatcha, Ibrahim Ali and Syed Osman Idid, Syed Zahir Idid and Eissa, Maimonah (2010) Quantum chemical quantitative structure activity studies of anticancer activity of Aldohexose chloroethylnitrosourea Analogs. In: 3rd International Conference on Advancement in Science and Technology (iCAST 2010), 26 - 29 November 2010, Vistana Hotel, Kuantan. (Unpublished) http://www.iium.edu.my/icast/2010/index.php?option=com_content&view=article&id=24&Itemid=19
repository_type	Digital Repository
institution_category	Local University
institution	International Islamic University Malaysia
building	IIUM Repository
collection	Online Access
language	English
topic	TP248.13 Biotechnology
spellingShingle	TP248.13 Biotechnology Noorbatcha, Ibrahim Ali Syed Osman Idid, Syed Zahir Idid Eissa, Maimonah Quantum chemical quantitative structure activity studies of anticancer activity of Aldohexose chloroethylnitrosourea Analogs
description	Quantitative structure activity relationship involving 18 aldohexose chloroethylnitrosourea compounds having anticancer activity against Ip-Implanted Murine L1210 Lymphoid Leukemia, is investigated using semi-empirical quantum chemical AM1 methods. Quantum chemical methods are used to calculate several electronic and molecular properties of these compounds and these properties are used to obtain the best QSAR using statistical procedures. A best QSAR with correlation coefficient of R2 = 0.7270 is established with four theoretical molecular descriptors. The QSAR obtained in our study can be used to predict the anticancer activity of new aldohexose chloroethylnitrosourea analogs, without resorting to any experimental studies.
format	Conference or Workshop Item
author	Noorbatcha, Ibrahim Ali Syed Osman Idid, Syed Zahir Idid Eissa, Maimonah
author_facet	Noorbatcha, Ibrahim Ali Syed Osman Idid, Syed Zahir Idid Eissa, Maimonah
author_sort	Noorbatcha, Ibrahim Ali
title	Quantum chemical quantitative structure activity studies of anticancer activity of Aldohexose chloroethylnitrosourea Analogs
title_short	Quantum chemical quantitative structure activity studies of anticancer activity of Aldohexose chloroethylnitrosourea Analogs
title_full	Quantum chemical quantitative structure activity studies of anticancer activity of Aldohexose chloroethylnitrosourea Analogs
title_fullStr	Quantum chemical quantitative structure activity studies of anticancer activity of Aldohexose chloroethylnitrosourea Analogs
title_full_unstemmed	Quantum chemical quantitative structure activity studies of anticancer activity of Aldohexose chloroethylnitrosourea Analogs
title_sort	quantum chemical quantitative structure activity studies of anticancer activity of aldohexose chloroethylnitrosourea analogs
publishDate	2010
url	http://irep.iium.edu.my/4099/ http://irep.iium.edu.my/4099/ http://irep.iium.edu.my/4099/4/ICAST2010_QSAR_%282%29.pdf
first_indexed	2023-09-18T20:12:11Z
last_indexed	2023-09-18T20:12:11Z
_version_	1777407551769411584

Quantum chemical quantitative structure activity studies of anticancer activity of Aldohexose chloroethylnitrosourea Analogs

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