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Complex #2546 — Ru(2) [1]

2D Structure

Structure
⬇ MOL V3000

Info

ID2546
MetalRu
Oxidation state2
Charge2
Donor atoms{"N": 8}
Abbreviation1
SMILESCc1ccc2c(n1)c1nc(C)ccc1c1nc3ccccc3nc21.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12

TUCAN

C44H30N8Ru/(1-31)(2-34)(3-59)(4-36)(5-31)(6-33)(7-42)(8-40)(9-38)(10-60)(11-31)(12-32)(13-37)(14-35)(15-39)(16-50)(17-41)(18-46)(19-32)(20-51)(21-61)(22-49)(23-62)(24-52)(25-45)(26-43)(27-48)(28-47)(29-44)(30-32)(31-67)(32-74)(33-46)(33-53)(34-36)(34-53)(35-49)(35-54)(36-59)(37-42)(37-54)(38-40)(38-55)(39-50)(39-68)(40-67)(41-43)(41-56)(42-60)(43-61)(44-51)(44-74)(45-52)(45-72)(46-56)(47-48)(47-57)(48-62)(49-57)(50-52)(51-58)(53-63)(54-64)(55-66)(55-70)(56-65)(57-71)(58-69)(58-73)(59-77)(60-78)(61-79)(62-81)(63-65)(63-77)(64-71)(64-78)(65-79)(66-69)(66-80)(67-80)(68-72)(68-75)(69-82)(70-73)(70-75)(71-81)(72-76)(73-76)(74-82)(77-83)(78-83)(79-83)(80-83)(81-83)(82-83)

Measurements (4)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
BEL-740214 10.1007/s11243-011-9575-y 2012
HeLa17 10.1007/s11243-011-9575-y 2012
MCF-722 10.1007/s11243-011-9575-y 2012
MG-6336 10.1007/s11243-011-9575-y 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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