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Complex #2003 — Ru(2) [2]

2D Structure

Structure
⬇ MOL V3000

Info

ID2003
MetalRu
Oxidation state2
Charge2
Donor atoms{"N": 6}
Abbreviation2
SMILESc1ccc2nc3c4cccnc4c4ncccc4c3nc2c1.c1ccc2nc3c4cccnc4c4ncccc4c3nc2c1.c1cnc2c(c1)c1nccnc1c1cccnc12

TUCAN

C50H28N12Ru/(1-29)(2-31)(3-59)(4-56)(5-57)(6-33)(7-58)(8-42)(9-32)(10-39)(11-60)(12-43)(13-46)(14-55)(15-62)(16-35)(17-47)(18-44)(19-37)(20-41)(21-34)(22-30)(23-36)(24-48)(25-45)(26-40)(27-61)(28-38)(29-43)(29-56)(30-46)(30-51)(31-39)(31-69)(32-37)(32-55)(33-35)(33-66)(34-47)(34-53)(35-39)(36-44)(36-60)(37-49)(38-40)(38-45)(40-74)(41-48)(41-61)(42-45)(42-78)(43-50)(44-52)(46-59)(47-58)(48-54)(49-63)(49-64)(50-65)(50-67)(51-75)(51-76)(52-70)(52-71)(53-68)(53-77)(54-72)(54-73)(55-88)(56-81)(57-62)(57-79)(58-86)(59-80)(60-84)(61-90)(62-85)(63-65)(63-87)(64-67)(64-88)(65-82)(66-69)(66-87)(67-81)(68-75)(68-85)(69-82)(70-72)(70-84)(71-73)(71-83)(72-90)(73-89)(74-78)(74-89)(75-79)(76-77)(76-80)(77-86)(78-83)(85-91)(86-91)(87-91)(88-91)(89-91)(90-91)

Measurements (2)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
HeLa18— 10.1016/j.ica.2012.01.023 2012
HepG223— 10.1016/j.ica.2012.01.023 2012

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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