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Complex #855 — Ru(2) [FOR0D2]

2D Structure

Structure
⬇ MOL V3000

Info

ID855
MetalRu
Oxidation state2
Charge2
Donor atoms{"N": 8}
AbbreviationFOR0D2
SMILESc1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1ccc2[nH]ncc2c1.c1ccc2[nH]ncc2c1

TUCAN

C34H28N8Ru/(1-33)(2-34)(3-37)(4-51)(5-31)(6-53)(7-54)(8-32)(9-55)(10-36)(11-35)(12-56)(13-29)(14-30)(15-44)(16-43)(17-41)(18-40)(19-38)(20-39)(21-46)(22-42)(23-52)(24-45)(25-48)(26-47)(27-63)(28-64)(29-30)(29-37)(30-38)(31-32)(31-53)(32-33)(33-57)(34-36)(34-59)(35-36)(35-54)(37-58)(38-49)(39-44)(39-45)(40-41)(40-42)(41-55)(42-61)(43-44)(43-60)(45-50)(46-48)(46-56)(47-48)(47-62)(49-51)(49-58)(50-52)(50-60)(51-69)(52-70)(53-65)(54-66)(55-67)(56-68)(57-61)(57-65)(58-63)(59-62)(59-66)(60-64)(61-67)(62-68)(63-69)(64-70)(65-71)(66-71)(67-71)(68-71)(69-71)(70-71)

Measurements (4)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
HepG27.2 10.1016/j.ica.2020.120125 2021
HCT-11612 10.1016/j.ica.2020.120125 2021
B16-F1016 10.1016/j.ica.2020.120125 2021
MRC-5 10.1016/j.ica.2020.120125 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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