Literature DB >> 1730145

The structure-activity relationship of skin carcinogenicity of aromatic hydrocarbons and heterocycles.

L Zhang1, K Sannes, A J Shusterman, C Hansch.   

Abstract

From a study of 239 aromatic and heteroaromatic compounds causing skin cancer in mice, a quantitative structure-activity relationship has been derived. Carcinogenicity depends heavily on the relative hydrophobicity of the chemicals as defined by octanol/water partition coefficients (log P). It is also correlated with the energy of the highest occupied molecular orbital and the presence of substituents on the L and K regions of the carcinogen. The results are discussed in terms of the bay region concept for carcinogenic activity.

Entities:  

Mesh:

Substances:

Year:  1992        PMID: 1730145     DOI: 10.1016/0009-2797(92)90032-g

Source DB:  PubMed          Journal:  Chem Biol Interact        ISSN: 0009-2797            Impact factor:   5.192


  4 in total

1.  Quantitative and qualitative models for carcinogenicity prediction for non-congeneric chemicals using CP ANN method for regulatory uses.

Authors:  Natalja Fjodorova; Marjan Vračko; Marjan Tušar; Aneta Jezierska; Marjana Novič; Ralph Kühne; Gerrit Schüürmann
Journal:  Mol Divers       Date:  2009-08-15       Impact factor: 2.943

2.  A mechanism-mediated model for carcinogenicity: model content and prediction of the outcome of rodent carcinogenicity bioassays currently being conducted on 25 organic chemicals.

Authors:  R Purdy
Journal:  Environ Health Perspect       Date:  1996-10       Impact factor: 9.031

Review 3.  In silico prediction of drug toxicity.

Authors:  John C Dearden
Journal:  J Comput Aided Mol Des       Date:  2003 Feb-Apr       Impact factor: 3.686

4.  A Mechanism-based QSTR Model for Acute to Chronic Toxicity Extrapolation: A Case Study of Antibiotics on Luminous Bacteria.

Authors:  Dali Wang; Yue Gu; Min Zheng; Wei Zhang; Zhifen Lin; Ying Liu
Journal:  Sci Rep       Date:  2017-07-20       Impact factor: 4.379

  4 in total

北京卡尤迪生物科技股份有限公司 © 2022-2023.