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Complex #259 — Ru(2) [1]

2D Structure

Structure
⬇ MOL V3000

Info

ID259
MetalRu
Oxidation state2
Charge2
Donor atoms{"N": 6}
Abbreviation1
SMILESc1ccc2nc3c4cccnc4c4ncccc4c3nc2c1.c1ccc2nc3c4cccnc4c4ncccc4c3nc2c1.c1ccc2nc3c4cccnc4c4ncccc4c3nc2c1

TUCAN

C54H30N12Ru/(1-32)(2-61)(3-62)(4-31)(5-35)(6-37)(7-36)(8-34)(9-33)(10-38)(11-43)(12-45)(13-40)(14-64)(15-42)(16-44)(17-39)(18-41)(19-63)(20-46)(21-51)(22-54)(23-48)(24-53)(25-49)(26-65)(27-52)(28-47)(29-66)(30-50)(31-32)(31-34)(32-72)(33-35)(33-62)(34-37)(35-56)(36-38)(36-55)(37-67)(38-66)(39-44)(39-78)(40-46)(40-61)(41-43)(41-44)(42-45)(42-63)(43-73)(45-58)(46-57)(47-50)(47-52)(48-49)(48-60)(49-64)(50-82)(51-54)(51-59)(52-53)(53-81)(54-65)(55-70)(55-71)(56-68)(56-69)(57-76)(57-77)(58-74)(58-75)(59-83)(59-84)(60-79)(60-80)(61-91)(62-85)(63-87)(64-94)(65-90)(66-95)(67-72)(67-92)(68-71)(68-85)(69-70)(69-86)(70-92)(71-95)(72-86)(73-78)(73-88)(74-76)(74-87)(75-77)(75-88)(76-91)(77-93)(78-93)(79-83)(79-94)(80-84)(80-96)(81-82)(81-89)(82-96)(83-90)(84-89)(91-97)(92-97)(93-97)(94-97)(95-97)(96-97)

Measurements (4)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
HeLa19 10.1016/j.saa.2014.06.147 2015
HepG222 10.1016/j.saa.2014.06.147 2015
MRC-542 10.1002/cbic.202000289 2020
HeLa2.1 10.1002/cbic.202000289 2020

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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