Interaction of chlorpromazine with 2'-deoxyguanosine-5'-monophosphate by PM3 calculation

Teruo Kurihara, Noboru Motohashi, Hidesaburo Kobayashi, Wataru Yamanaka, Shin Ichi Dohyashiki, J. Molnár

Research output: Contribution to journalArticle

4 Citations (Scopus)

Abstract

Using the PM3 method, the interactions between chlorpromazine (CPZ) with 2'-deoxyguanosine-5'-monophosphate (dGMP) were examined. We obtained the optimized geometrical structure of each CPZ, dGMP and a CPZ-dGMP system in both aqueous-phase and gaseous-phase and investigated their geometric and electric changes and Force calculation. By Force calculation, three vibrations at 835, 800 and 737 cm-1 were assigned to the antisymmetric and symmetric P-O stretching vibration of PO32- group in Z-dGMP, respectively. The vibrations at 889, 803 and 799 cm-1 due to the C5'-O-PO32- stretching vibration shifted to their corresponding higher wave numbers, comparing to those of Z-dGMP alone.

Original languageEnglish
Pages (from-to)3493-3497
Number of pages5
JournalAnticancer Research
Volume18
Issue number5 A
Publication statusPublished - Sep 1998

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Chlorpromazine
Vibration
2'-deoxyguanosine 5'-phosphate

Keywords

  • Chlorpromazine
  • COSMO calculation
  • dGMP
  • IR spectra
  • PM3 method

ASJC Scopus subject areas

  • Cancer Research
  • Oncology

Cite this

Kurihara, T., Motohashi, N., Kobayashi, H., Yamanaka, W., Dohyashiki, S. I., & Molnár, J. (1998). Interaction of chlorpromazine with 2'-deoxyguanosine-5'-monophosphate by PM3 calculation. Anticancer Research, 18(5 A), 3493-3497.

Interaction of chlorpromazine with 2'-deoxyguanosine-5'-monophosphate by PM3 calculation. / Kurihara, Teruo; Motohashi, Noboru; Kobayashi, Hidesaburo; Yamanaka, Wataru; Dohyashiki, Shin Ichi; Molnár, J.

In: Anticancer Research, Vol. 18, No. 5 A, 09.1998, p. 3493-3497.

Research output: Contribution to journalArticle

Kurihara, T, Motohashi, N, Kobayashi, H, Yamanaka, W, Dohyashiki, SI & Molnár, J 1998, 'Interaction of chlorpromazine with 2'-deoxyguanosine-5'-monophosphate by PM3 calculation', Anticancer Research, vol. 18, no. 5 A, pp. 3493-3497.
Kurihara T, Motohashi N, Kobayashi H, Yamanaka W, Dohyashiki SI, Molnár J. Interaction of chlorpromazine with 2'-deoxyguanosine-5'-monophosphate by PM3 calculation. Anticancer Research. 1998 Sep;18(5 A):3493-3497.
Kurihara, Teruo ; Motohashi, Noboru ; Kobayashi, Hidesaburo ; Yamanaka, Wataru ; Dohyashiki, Shin Ichi ; Molnár, J. / Interaction of chlorpromazine with 2'-deoxyguanosine-5'-monophosphate by PM3 calculation. In: Anticancer Research. 1998 ; Vol. 18, No. 5 A. pp. 3493-3497.
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