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Complex #4815 — Ru(2) [Ru]

2D Structure

Structure
⬇ MOL V3000

Info

ID4815
MetalRu
Oxidation state2
Charge2
Donor atoms{"N": 8}
AbbreviationRu
SMILESOc1ccc(-c2nc3c4cccnc4c4ncccc4c3n2-c2ccccc2)cc1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1

TUCAN

C45H32N8ORu/(1-61)(2-38)(3-37)(4-62)(5-34)(6-56)(7-63)(8-35)(9-33)(10-45)(11-57)(12-49)(13-39)(14-51)(15-44)(16-40)(17-42)(18-41)(19-43)(20-50)(21-36)(22-46)(23-66)(24-52)(25-64)(26-65)(27-55)(28-48)(29-47)(30-54)(31-53)(32-86)(33-37)(33-67)(34-37)(34-61)(35-47)(35-62)(36-46)(36-68)(38-40)(38-45)(39-44)(39-65)(40-56)(41-43)(41-60)(42-51)(42-77)(43-64)(44-58)(45-71)(46-49)(47-48)(48-72)(49-63)(50-53)(50-66)(51-59)(52-55)(52-77)(53-54)(54-73)(55-59)(56-57)(57-71)(58-69)(58-74)(59-76)(60-70)(60-75)(61-80)(62-81)(63-82)(64-78)(65-85)(66-83)(67-68)(67-80)(68-82)(69-75)(69-84)(70-74)(70-78)(71-79)(72-73)(72-81)(73-83)(74-85)(75-79)(76-79)(76-84)(77-86)(80-87)(81-87)(82-87)(83-87)(84-87)(85-87)(86-87)

Measurements (5)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
CT-26 10.1002/chem.202301742 2023
MCF-7 10.1039/d4cc04217d 2024
4T1 10.1039/d4cc04217d 2024
HCT-116 10.1039/d4cc04217d 2024
HK-2 10.1039/d4cc04217d 2024

🧬 Cell Death Types (2)

Apoptosis high
«achieves a strong therapeutic effect through the synergistic induction of ferroptosis and apoptosis.»
Ferroptosis high
«achieves a strong therapeutic effect through the synergistic induction of ferroptosis and apoptosis.»

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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