Background: Reckoning molecular topological indices of drug structures gives the data
about the underlying topology of these drug structures. Novel anticancer drugs have been leading
by researchers to produce ideal drugs.
Materials and Methods: Pharmacological properties of these new drug agents explored by utilizing
simulation strategies. Topological indices additionally have been utilized to research pharmacological
properties of some drug structures. Novel alkylating agents based anticancer drug candidates
and ve-degree molecular topological indices have been introduced recently.
Results and Conclusion: In this study we calculate ve-degree atom-bond connectivity, harmonic,
geometric-arithmetic and sum-connectivity molecular topological indices for the newly defined
alkylating agents based dual-target anticancer drug candidates.