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Complex #2900 — Ru(2) [Ru-2]

2D Structure

Structure
⬇ MOL V3000

Info

ID2900
MetalRu
Oxidation state2
Charge1
Donor atoms{"N": 3}
AbbreviationRu-2
SMILESCc1ccc(C(C)C)cc1.NC(=S)NN=c1c(=O)c2ccccc2c1=O.[Cl-]

TUCAN

C20ClN3O2RuS/(1-12)(2-13)(3-12)(4-5)(4-15)(5-6)(6-11)(7-8)(7-13)(8-14)(9-10)(9-13)(10-14)(11-16)(12-14)(15-16)(15-18)(16-19)(17-18)(17-19)(17-22)(18-24)(19-25)(20-21)(20-23)(20-26)(22-23)

Measurements (3)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
HeLa15— 10.1016/j.ica.2020.119641 2020
MDA-MB-2311.3e+02— 10.1016/j.ica.2020.119641 2020
HEK2931.3e+02— 10.1016/j.ica.2020.119641 2020

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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