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Complex #77 — Ru(2) [Ru4]

2D Structure

Structure
⬇ MOL V3000

Info

ID77
MetalRu
Oxidation state2
Charge2
Donor atoms{"N": 6}
AbbreviationRu4
SMILESc1cc2ccc3cccc4c5nc(-c6cnccn6)nnc5c(c1)c2c34.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12

TUCAN

C45H27N9Ru/(1-35)(2-33)(3-46)(4-39)(5-47)(6-34)(7-29)(8-58)(9-30)(10-28)(11-59)(12-37)(13-31)(14-32)(15-42)(16-41)(17-40)(18-63)(19-36)(20-38)(21-44)(22-61)(23-64)(24-60)(25-43)(26-62)(27-45)(28-29)(28-58)(29-48)(30-37)(30-49)(31-44)(31-48)(32-35)(32-40)(33-34)(33-51)(34-50)(35-50)(36-42)(36-53)(37-59)(38-43)(38-56)(39-46)(39-55)(40-57)(41-45)(41-49)(42-61)(43-62)(44-53)(45-56)(46-47)(47-51)(48-65)(49-66)(50-54)(51-52)(52-54)(52-55)(53-67)(54-57)(55-70)(56-68)(57-71)(58-76)(59-77)(60-69)(60-78)(61-79)(62-80)(63-64)(63-73)(64-78)(65-67)(65-76)(66-68)(66-77)(67-79)(68-80)(69-72)(69-73)(70-71)(70-81)(71-74)(72-75)(72-81)(74-75)(76-82)(77-82)(78-82)(79-82)(80-82)(81-82)

Measurements (9)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
A54965— 10.1002/anie.202006089 2020
SGC-790171— 10.1002/anie.202006089 2020
SGC-7901/DDP81— 10.1002/anie.202006089 2020
A549cisR1.6e+02— 10.1002/anie.202006089 2020
BEAS-2B1.6e+02— 10.1002/anie.202006089 2020
HeLa1.6e+02— 10.1002/anie.202006089 2020
LO21.9e+02— 10.1002/anie.202006089 2020
HepG2—— 10.1002/anie.202006089 2020
BEL-7402—— 10.1002/anie.202006089 2020

🧬 Cell Death Types (1)

Necroptosis high
«Ru7 effectively inhibits the endogenous activities of topoisomerase (topo) I and II and kills cancer cells by necroptosis.»

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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