Computational Exploration for Lead Compounds That Can Reverse the Nuclear Morphology in Progeria

<table class="table-group" id="tab6"><tr><td><table class="table"><tr><td class="thead-hr" colspan="3"><hr/></td></tr><tr class="thead"><td class="align_left">Compound name</td><td class="align_center">Ligand atoms</td><td class="align_center">Mulliken atomic charges (au)</td></tr><tr><td class="thead-hr" colspan="3"><hr/></td></tr><tr><td class="align_left">Reference</td><td class="align_center">O2</td><td class="align_center">−0.449</td></tr><tr><td class="align_left" rowspan="2">Lonafarnib</td><td class="align_center">O5</td><td class="align_center">−0.527</td></tr><tr><td class="align_center">N8</td><td class="align_center">−0.303</td></tr><tr><td class="align_left">Hit 1</td><td class="align_center">O24</td><td class="align_center">−0.448</td></tr><tr><td class="align_left">Hit 2</td><td class="align_center">O10</td><td class="align_center">−0.437</td></tr><tr class="table-tr"><td colspan="3"><hr class="tbody-hr"/></td></tr></table></td></tr></table>

Mulliken atomic charges of the atoms involved in hydrogen bonds.

BioMed Research International

tab6

Table 6

Table 6: Computational Exploration for Lead Compounds That Can Reverse the Nuclear Morphology in Progeria 