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Complex #4285 — Ru(2) [1]

2D Structure

Structure
⬇ MOL V3000

Info

ID4285
MetalRu
Oxidation state2
Charge1
Donor atoms{"N": 3}
Abbreviation1
SMILESC(=N/c1ccccc1)\c1ncc[nH]1.Cc1ccc(C(C)C)cc1.[Cl-]

TUCAN

C20H23N3Ru/(1-24)(2-27)(3-24)(4-25)(5-25)(6-24)(7-29)(8-26)(9-26)(10-26)(11-32)(12-33)(13-39)(14-40)(15-30)(16-25)(17-28)(18-38)(19-41)(20-34)(21-31)(22-35)(23-44)(24-38)(25-37)(26-38)(27-29)(27-36)(28-30)(28-36)(29-37)(30-37)(31-32)(31-42)(32-33)(33-34)(34-35)(35-42)(36-38)(39-40)(39-44)(40-45)(41-43)(41-46)(42-46)(43-44)(43-45)(45-47)(46-47)

Measurements (6)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
HepG26— 10.1039/c5dt04781a 2016
MIA PaCa-27— 10.1039/c5dt04781a 2016
MCF-79— 10.1039/c5dt04781a 2016
NIH-3T310— 10.1039/c5dt04781a 2016
HFF-110— 10.1039/c5dt04781a 2016
A54921— 10.1039/c5dt04781a 2016

🧬 Cell Death Types (1)

Apoptosis high
«The cellular studies show that all the three complexes ... induce cellular death through caspase activation via the mitochondrial pathway.»

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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