home← all complexes Ir builderC^N familiesD-MPNN

Complex #2152 — Ru(2) [4]

2D Structure

Structure
⬇ MOL V3000

Info

ID2152
MetalRu
Oxidation state2
Charge0
Donor atoms{"N": 2, "O": 1}
Abbreviation4
SMILESCc1ccc(C(C)C)cc1.O=C(NC(=S)Nc1cc(Cl)ccc1[N+](=O)[O-])c1ccco1.[Cl-].[Cl-]

TUCAN

C22Cl3N3O4RuS/(1-14)(2-13)(3-13)(4-5)(4-15)(5-14)(6-10)(6-18)(7-8)(7-16)(8-22)(9-12)(9-14)(10-19)(11-17)(11-22)(12-15)(13-15)(16-17)(16-25)(17-24)(18-27)(19-20)(19-27)(20-23)(20-26)(21-23)(21-24)(21-30)(22-33)(25-28)(25-29)

Measurements (4)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
MDA-MB-23122— 10.1021/acs.inorgchem.3c00757 2023
T47D24— 10.1021/acs.inorgchem.3c00757 2023
MCF-729— 10.1021/acs.inorgchem.3c00757 2023
MCF-10A—— 10.1021/acs.inorgchem.3c00757 2023

🧬 Cell Death Types (1)

Apoptosis high
«The most active complexes were tested for their mode of cell death through staining assays, which confirmed apoptosis. The upregulation of apoptotic inducing and downregulation of apoptotic suppressin...»

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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