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Complex #2690 — Ru(2) [4a]

2D Structure

Structure
⬇ MOL V3000

Info

ID2690
MetalRu
Oxidation state2
Charge0
Donor atoms{"O": 2}
Abbreviation4a
SMILES[C-]#[O+].[C-]#[O+].[Cl-].c1ccc(Cc2c(Cc3ccccc3)c(Cc3ccccc3)[c-](Cc3ccccc3)c2Cc2ccccc2)cc1

TUCAN

C42ClO2Ru/(1-2)(1-3)(2-4)(3-31)(4-6)(5-10)(5-12)(6-31)(7-12)(7-16)(8-15)(8-17)(9-31)(9-34)(10-32)(11-15)(11-20)(13-21)(13-22)(14-32)(14-35)(16-32)(17-33)(18-22)(18-23)(19-33)(19-38)(20-33)(21-36)(23-36)(24-36)(24-39)(25-26)(25-27)(26-28)(27-29)(28-37)(29-37)(30-37)(30-40)(34-35)(34-38)(35-39)(38-40)(39-40)(41-43)(42-44)

Measurements (5)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
HeLa46— 10.1021/om400234p 2014
HeLa—— 10.1021/om400234p 2014
MCF-7—— 10.1021/om400234p 2014
A431—— 10.1021/om400234p 2014
A2780—— 10.1021/om400234p 2014

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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