QSAR Studies of Toxicity Towards Monocytes with (1,3-benzothiazol-2-yl) amino-9-(10H)-acridinone Derivatives Using Electronic Descriptors

QSAR Studies of Toxicity Towards Monocytes with (1,3-benzothiazol-2-yl) amino-9-(10H)-acridinone Derivatives Using Electronic Descriptors

DFT-B3LYP method, with the basis set 6-31G (d), was employed to calculate nine quantum chemical descriptors of 16 acridin-9-(10H)-ones substituted with amino or (1,3-benzothiazol-2-yl)-amino groups compounds. The above descriptors were used to establish a Quantitative Structure Activity Relationship...

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Bibliographic Details
Main Authors: Samir Chtita, Majdouline Larif, Mounir Ghamali, Mohammed Bouachrine, Tahar Lakhlifi
Format: Article
Language:English
Published: Universidade Federal de Mato Grosso do Sul 2015-06-01
Series:Orbital: The Electronic Journal of Chemistry
Subjects:
acridinone
anti-proliferative
QSAR
DFT
MLR
Online Access:https://periodicos.ufms.br/index.php/orbital/article/view/17887

Internet

https://periodicos.ufms.br/index.php/orbital/article/view/17887

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