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Complex #254 — Ru(3) [AziRu]

2D Structure

Structure
⬇ MOL V3000

Info

ID254
MetalRu
Oxidation state3
Charge-1
Donor atoms{"S": 1, "O": 1, "N": 1}
AbbreviationAziRu
SMILESCS(C)=O.[Cl-].[Cl-].[Cl-].[Cl-].c1ccncc1

TUCAN

C7H11NORuS/(1-13)(2-14)(3-12)(4-15)(5-17)(6-17)(7-17)(8-18)(9-18)(10-16)(11-18)(12-13)(12-14)(13-15)(14-16)(15-19)(16-19)(17-21)(18-21)(19-22)(20-21)(21-22)

Measurements (18)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
MCF-73e+02 10.1039/c4tb01807a 2015
MCF-73e+02 10.1021/bm400104b 2013
C63.2e+02 10.1021/bm400104b 2013
HeLa3.8e+02 10.1039/c4tb01807a 2015
WiDr4.4e+02 10.1021/bm400104b 2013
WiDr5.2e+02 10.1039/c4tb01807a 2015
MCF-7 10.1038/srep45236 2017
MDA-MB-231 10.1038/srep45236 2017
MDA-MB-436 10.1038/srep45236 2017
MDA-MB-468 10.1038/srep45236 2017
CG-5 10.1038/srep45236 2017
HaCaT 10.1039/c4tb01807a 2015
L6 10.1039/c4tb01807a 2015
MCF-7 10.1016/j.bioadv.2022.213016 2022
MDA-MB-231 10.1016/j.bioadv.2022.213016 2022
A375 10.1016/j.bioadv.2022.213016 2022
HCT-116 10.1016/j.bioadv.2022.213016 2022
HaCaT 10.1016/j.bioadv.2022.213016 2022

🧬 Cell Death Types (2)

Apoptosis high
«the most efficient ruthenium-containing cationic nanoaggregates we have hitherto developed are able to elicit both extrinsic and intrinsic apoptosis, as well as autophagy.»
Autophagy high
«the cationic DoHuRu/DOTAP formulation induced an evident increase in the Mean Fluorescence Intensity (MFI), in particular 4.3 and 5.8-fold higher at 48 and 72 h for MCF-7, and 3.9 and 5.3-fold higher ...»

Source-assisted 2D generator

Builds the drawing from source ligand graphs and explicit donor metadata, then uses Metal2D only for layout. Publication output uses black bonds without arrows or colour highlighting; validated octahedral enantiomers are encoded directly with solid and hashed wedge bonds.

experimental validation surface
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