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Complex #2051 — Ru(2) [3]

2D Structure

Structure
⬇ MOL V3000

Info

ID2051
MetalRu
Oxidation state2
Charge2
Donor atoms{"N": 6}
Abbreviation3
SMILESOc1nc(O)c2nc3c4cccnc4c4ncccc4c3nc2n1.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12

TUCAN

C40H24N10O2Ru/(1-47)(2-25)(3-28)(4-26)(5-48)(6-51)(7-29)(8-30)(9-27)(10-31)(11-40)(12-34)(13-32)(14-33)(15-35)(16-38)(17-37)(18-52)(19-50)(20-49)(21-39)(22-36)(23-76)(24-75)(25-28)(25-41)(26-31)(26-41)(27-36)(27-43)(28-47)(29-38)(29-48)(30-39)(30-51)(31-43)(32-34)(32-42)(33-40)(33-50)(34-49)(35-37)(35-44)(36-52)(37-45)(38-44)(39-45)(40-46)(41-53)(42-57)(42-60)(43-54)(44-55)(45-56)(46-58)(46-59)(47-69)(48-70)(49-68)(50-66)(51-71)(52-74)(53-54)(53-69)(54-74)(55-56)(55-70)(56-71)(57-59)(57-72)(58-60)(58-66)(59-67)(60-68)(61-62)(61-63)(61-72)(62-65)(62-67)(63-73)(63-76)(64-65)(64-73)(64-75)(69-77)(70-77)(71-77)(72-77)(73-77)(74-77)

Measurements (5)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
HeLa18— 10.1039/c5ra00553a 2015
BEL-740219— 10.1039/c5ra00553a 2015
MG-6321— 10.1039/c5ra00553a 2015
A54926— 10.1039/c5ra00553a 2015
HepG230— 10.1039/c5ra00553a 2015

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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