home← all complexes Ir builderC^N familiesD-MPNN

Complex #103 — Ru(2) [6]

2D Structure

Structure
⬇ MOL V3000

Info

ID103
MetalRu
Oxidation state2
Charge0
Donor atoms{"O": 1, "N": 2}
Abbreviation6
SMILESCOc1ccc(/C([O-])=N/N=C\c2c3ccccc3cc3ccccc23)cc1.Cc1ccc(C(C)C)cc1.[Cl-]

TUCAN

C33H31N2O2Ru/(1-32)(2-36)(3-32)(4-35)(5-32)(6-37)(7-33)(8-33)(9-33)(10-38)(11-34)(12-48)(13-41)(14-44)(15-43)(16-40)(17-46)(18-42)(19-39)(20-34)(21-50)(22-62)(23-62)(24-62)(25-49)(26-45)(27-34)(28-60)(29-51)(30-61)(31-47)(32-60)(33-60)(34-57)(35-36)(35-52)(36-57)(37-38)(37-52)(38-57)(39-48)(39-58)(40-43)(40-44)(41-55)(41-59)(42-44)(42-55)(43-53)(45-46)(45-47)(46-51)(47-59)(48-63)(49-50)(49-58)(50-63)(51-56)(52-60)(53-54)(53-55)(54-56)(54-61)(56-59)(58-64)(61-65)(62-68)(63-68)(64-66)(64-67)(65-66)(65-69)(66-69)(68-69)

Measurements (4)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
MDA-MB-2315 10.1039/c6qi00197a 2016
HepG210 10.1039/c6qi00197a 2016
HeLa14 10.1039/c6qi00197a 2016
NIH-3T32.4e+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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