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Complex #846 — Ru(2) [1]

2D Structure

Structure
⬇ MOL V3000

Info

ID846
MetalRu
Oxidation state2
Charge1
Donor atoms{"N": 2}
Abbreviation1
SMILESCc1ccc(C(C)C)cc1.NCc1ccccn1.[Cl-]

TUCAN

C16ClN2Ru/(1-13)(2-12)(3-13)(4-5)(4-12)(5-11)(6-7)(6-15)(7-10)(8-9)(8-11)(9-12)(10-16)(11-13)(14-16)(14-17)(15-18)(16-18)

Measurements (3)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
HeLa21 10.1016/j.poly.2021.115379 2021
MCF-721 10.1016/j.poly.2021.115379 2021
HEK29339 10.1016/j.poly.2021.115379 2021

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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