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Complex #2249 — Ru(2) [3]

2D Structure

Structure
⬇ MOL V3000

Info

ID2249
MetalRu
Oxidation state2
Charge2
Donor atoms{"N": 6}
Abbreviation3
SMILESc1ccc(CCSCCSCCc2ccccn2)nc1.c1ccc2nc3c4cccnc4c4ncccc4c3nc2c1

TUCAN

C34H30N6RuS2/(1-50)(2-45)(3-33)(4-35)(5-41)(6-32)(7-63)(8-36)(9-40)(10-49)(11-63)(12-45)(13-61)(14-61)(15-62)(16-64)(17-46)(18-38)(19-42)(20-62)(21-64)(22-34)(23-44)(24-51)(25-52)(26-31)(27-37)(28-46)(29-39)(30-43)(31-35)(31-57)(32-34)(32-47)(33-41)(33-54)(34-52)(35-41)(36-37)(36-50)(37-38)(38-55)(39-40)(39-48)(40-49)(42-43)(42-51)(43-44)(44-56)(45-55)(45-63)(46-56)(46-64)(47-59)(47-60)(48-53)(48-58)(49-68)(50-69)(51-70)(52-66)(53-59)(53-67)(54-57)(54-65)(55-69)(56-70)(57-67)(58-60)(58-68)(59-65)(60-66)(61-62)(61-71)(62-72)(63-71)(64-72)(67-73)(68-73)(69-73)(70-73)(71-73)(72-73)

Measurements (7)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
HaCaT8— 10.1039/B710578A 2008
NCI-H46021— 10.1039/B710578A 2008
MDA-MB-46854— 10.1039/B710578A 2008
A375—— 10.1039/B710578A 2008
MDA-MB-435—— 10.1039/B710578A 2008
U373—— 10.1039/B710578A 2008
HT-1080—— 10.1039/B710578A 2008

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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