home← all complexes Ir builderC^N familiesD-MPNN

Complex #102 — Ru(2) [5]

2D Structure

Structure
⬇ MOL V3000

Info

ID102
MetalRu
Oxidation state2
Charge0
Donor atoms{"O": 1, "N": 2}
Abbreviation5
SMILESCc1ccc(C(C)C)cc1.[Cl-].[O-]/C(=N\N=C/c1c2ccccc2cc2ccccc12)c1ccc(Cl)cc1

TUCAN

C32H28ClN2ORu/(1-45)(2-39)(3-36)(4-30)(5-30)(6-35)(7-32)(8-38)(9-42)(10-43)(11-46)(12-41)(13-40)(14-58)(15-34)(16-33)(17-44)(18-47)(19-30)(20-29)(21-29)(22-31)(23-48)(24-57)(25-29)(26-31)(27-37)(28-31)(29-53)(30-57)(31-57)(32-43)(32-60)(33-52)(33-55)(34-38)(34-49)(35-36)(35-53)(36-54)(37-48)(37-54)(38-45)(39-45)(39-52)(40-44)(40-46)(41-46)(41-55)(42-47)(42-60)(43-56)(44-50)(47-56)(48-53)(49-51)(49-52)(50-51)(50-55)(51-58)(54-57)(56-59)(58-62)(59-61)(59-63)(60-64)(61-62)(61-65)(62-65)

Measurements (4)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
MDA-MB-23118 10.1039/c6qi00197a 2016
HepG223 10.1039/c6qi00197a 2016
HeLa23 10.1039/c6qi00197a 2016
NIH-3T32.3e+02 10.1039/c6qi00197a 2016

🧬 Cell Death Types (1)

Apoptosis high
«Furthermore, the results of AO–EB, Hoechst 33258 and flow cytometry analyses reveal that these complexes induce cell death only through 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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