Computational investigations of physicochemical, pharmacokinetic, toxicological properties and molecular docking of betulinic acid, a constituent of Corypha taliera (Roxb.) with Phospholipase A2 (PLA2).

Khan, Mohammad Firoz; Nahar, Nusrat; Rashid, Ridwan Bin; Chowdhury, Akhtaruzzaman; Rashid, Mohammad A

Khan, Mohammad Firoz; Nahar, Nusrat; Rashid, Ridwan Bin; Chowdhury, Akhtaruzzaman; Rashid, Mohammad A.

Afiliação

Khan MF; Department of Pharmacy, State University of Bangladesh, Dhaka, 1205, Bangladesh.
Nahar N; Department of Pharmacy, State University of Bangladesh, Dhaka, 1205, Bangladesh.
Rashid RB; Department of Pharmacy, State University of Bangladesh, Dhaka, 1205, Bangladesh.
Chowdhury A; Department of Chemistry, Rajshahi University of Engineering and Technology, Rajshahi, Bangladesh.
Rashid MA; Department of Pharmaceutical Chemistry, University of Dhaka, Dhaka, 1000, Bangladesh. rashidma@du.ac.bd.

BMC Complement Altern Med ; 18(1): 48, 2018 Feb 02.

Article em En | MEDLINE | ID: mdl-29391000

Assuntos

Fosfolipases A2/química; Fosfolipases A2/metabolismo; Triterpenos/química; Triterpenos/metabolismo; Fenômenos Químicos; Concentração de Íons de Hidrogênio; Simulação de Acoplamento Molecular; Triterpenos Pentacíclicos; Fosfolipases A2/análise; Ligação Proteica; Termodinâmica; Triterpenos/análise; Ácido Betulínico

Palavras-chave

Carcinogenic; Molecular docking; Pharmacokinetic; Physicochemical properties; Polarizability; Solvation free energy; Toxicology

Texto completo

Imprimir

XML

PubMed Links

Buscar no Google

Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Assunto principal: Triterpenos / Fosfolipases A2 Idioma: En Revista: BMC Complement Altern Med Ano de publicação: 2018 Tipo de documento: Article

Texto completo

Imprimir

XML

PubMed Links

Buscar no Google