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Author:

Huang, Tao (Huang, Tao.) | Sun, Guohui (Sun, Guohui.) | Zhao, Lijiao (Zhao, Lijiao.) (Scholars:赵丽娇) | Zhang, Na (Zhang, Na.) | Zhong, Rugang (Zhong, Rugang.) (Scholars:钟儒刚) | Peng, Yongzhen (Peng, Yongzhen.) (Scholars:彭永臻)

Indexed by:

Scopus SCIE

Abstract:

Nitroaromatic compounds (NACs) are ubiquitous in the environment due to their extensive industrial applications. The recalcitrance of NACs causes their arduous degradation, subsequently bringing about potential threats to human health and environmental safety. The problem of how to effectively predict the toxicity of NACs has drawn public concern over time. Quantitative structure-activity relationship (QSAR) is introduced as a cost-effective tool to quantitatively predict the toxicity of toxicants. Both OECD (Organization for Economic Co-operation and Development) and REACH (Registration, Evaluation and Authorization of Chemicals) legislation have promoted the use of QSAR as it can significantly reduce living animal testing. Although numerous QSAR studies have been conducted to evaluate the toxicity of NACs, systematic reviews related to the QSAR modeling of NACs toxicity are less reported. The purpose of this review is to provide a thorough summary of recent QSAR studies on the toxic effects of NACs according to the corresponding classes of toxic response endpoints.

Keyword:

QSAR toxicity nitroaromatic compounds in silico modeling animal testing

Author Community:

  • [ 1 ] [Huang, Tao]Beijing Univ Technol, Coll Life Sci & Chem, Fac Environm & Life, Key Lab Environm & Viral Oncol, Beijing 100124, Peoples R China
  • [ 2 ] [Sun, Guohui]Beijing Univ Technol, Coll Life Sci & Chem, Fac Environm & Life, Key Lab Environm & Viral Oncol, Beijing 100124, Peoples R China
  • [ 3 ] [Zhao, Lijiao]Beijing Univ Technol, Coll Life Sci & Chem, Fac Environm & Life, Key Lab Environm & Viral Oncol, Beijing 100124, Peoples R China
  • [ 4 ] [Zhang, Na]Beijing Univ Technol, Coll Life Sci & Chem, Fac Environm & Life, Key Lab Environm & Viral Oncol, Beijing 100124, Peoples R China
  • [ 5 ] [Zhong, Rugang]Beijing Univ Technol, Coll Life Sci & Chem, Fac Environm & Life, Key Lab Environm & Viral Oncol, Beijing 100124, Peoples R China
  • [ 6 ] [Peng, Yongzhen]Beijing Univ Technol, Coll Environm & Chem Engn, Fac Environm & Life, Natl Engn Lab Adv Municipal Wastewater Treatment, Beijing 100124, Peoples R China

Reprint Author's Address:

  • [Sun, Guohui]Beijing Univ Technol, Coll Life Sci & Chem, Fac Environm & Life, Key Lab Environm & Viral Oncol, Beijing 100124, Peoples R China

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Source :

INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES

Year: 2021

Issue: 16

Volume: 22

5 . 6 0 0

JCR@2022

ESI Discipline: CHEMISTRY;

ESI HC Threshold:96

JCR Journal Grade:1

Cited Count:

WoS CC Cited Count: 37

SCOPUS Cited Count: 47

ESI Highly Cited Papers on the List: 0 Unfold All

WanFang Cited Count:

Chinese Cited Count:

30 Days PV: 0

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