Rational design of efficient photosensitizers based on cyclometalated iridium(<scp>iii</scp>) complexes with 2-arylbenzimidazole and aromatic 1,3-diketone ligands

Tatarin, Sergei V.; Meshcheriakova, Elizaveta A.; Kozyukhin, Sergey A.; Emets, Victor V.; Bezzubov, Stanislav I.

doi:10.1039/d3dt02789a

Dalton Trans.

2023

DOI: 10.1039/d3dt02789a

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Rational design of efficient photosensitizers based on cyclometalated iridium(iii) complexes with 2-arylbenzimidazole and aromatic 1,3-diketone ligands

Sergei V. Tatarin,

Elizaveta A. Meshcheriakova,

Sergey A. Kozyukhin

et al.

Abstract: A judicious selection of substituents in cyclometalating 2-arylbenzimidazoles and an ancillary aromatic 1,3-diketone enabled the creation of heteroleptic iridium(III) complexes demonstrating strong light absorption up to 500 nm (ε ≈...

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IrCytoToxDB: a dataset of iridium(III) complexes cytotoxicities against various cell lines

Krasnov,

Tatarin,

Smirnov

et al. 2024

Sci Data

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Iridium(III) complexes nowadays became rising stars in various health-related applications. Thus, there is a necessity to assess cytotoxicity of the synthesized molecules against cancer/normal cell lines. In this report, we present a dataset of 2694 experimental cytotoxicity values of 803 iridium complexes against 127 different cell lines. We specify the experimental conditions and provide representation of the complexes molecules in machine-readable format. The dataset provides a starting point for exploration of new iridium-based cellular probes and opens new possibilities for predictions of toxicities and data-driven generation of new organometallic anticancer agents.

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IrCytoToxDB: a dataset of iridium(III) complexes cytotoxicities against various cell lines

Krasnov,

Tatarin,

Smirnov

et al. 2024

Sci Data

View full text Add to dashboard Cite

show abstract

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Rational design of efficient photosensitizers based on cyclometalated iridium(iii) complexes with 2-arylbenzimidazole and aromatic 1,3-diketone ligands

Abstract: A judicious selection of substituents in cyclometalating 2-arylbenzimidazoles and an ancillary aromatic 1,3-diketone enabled the creation of heteroleptic iridium(III) complexes demonstrating strong light absorption up to 500 nm (ε ≈...

Cited by 1 publication

References 70 publications

IrCytoToxDB: a dataset of iridium(III) complexes cytotoxicities against various cell lines

IrCytoToxDB: a dataset of iridium(III) complexes cytotoxicities against various cell lines

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