Investigation of Proton and Sodium Ion Affinities of Topiramate (anticonvulsant drug) by DFT Calculations

Hamid SAEİDİAN

Makale detayları

Investigation of Proton and Sodium Ion Affinities of Topiramate (anticonvulsant drug) by DFT Calculations

Yazarlar:

Hamid SAEİDİAN

Yayıncı:

Koray SAYIN

Ana Başlıklar:

Kimya mühendisliği

Dergi:

Turkish Computational and Theoretical Chemistry 2017 Vol.1 Issue 2, pp.1-5

Belge Tipi:

Makale

Yayın Tarihi:

12/2017

Belge Dili:

İngilizce

Document ID (Org No.):

2000628507

Sıklık:

Üç Yıllık

eISSN:

2602-3237

pISSN:

2587-1722

Özet:

 


The
proton and sodium ion affinities of Topiramate has been investigated by DFT
approach. The most basic site for protonation on Topiramate is nitrogen atom of
sulfamate group.  It is also interesting
that sodium ion affinity of Topiramate was determined as 670 kJ mol-1
is less than its proton ion affinity. Because of the limited understanding of the biological
molecular mechanism of Topiramate, these results might devise a clear
understanding of the role of Topiramate in blockade of voltage-dependent sodium
channels in biological systems.

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Makale detayları

Investigation of Proton and Sodium Ion Affinities of Topiramate (anticonvulsant drug) by DFT Calculations

Yazarlar: Hamid SAEİDİAN

Yayıncı: Koray SAYIN

Ana Başlıklar: Kimya mühendisliği

Dergi: Turkish Computational and Theoretical Chemistry 2017 Vol.1 Issue 2, pp.1-5

Belge Tipi: Makale

Yayın Tarihi: 12/2017

Belge Dili: İngilizce

Document ID (Org No.): 2000628507

Sıklık: Üç Yıllık

eISSN: 2602-3237

pISSN: 2587-1722

Sayı

Yazarlar:

Hamid SAEİDİAN

Yayıncı:

Koray SAYIN

Ana Başlıklar:

Kimya mühendisliği

Dergi:

Turkish Computational and Theoretical Chemistry 2017 Vol.1 Issue 2, pp.1-5

Belge Tipi:

Makale

Yayın Tarihi:

12/2017

Belge Dili:

İngilizce

Document ID (Org No.):

2000628507

Sıklık:

Üç Yıllık

eISSN:

2602-3237

pISSN:

2587-1722