home← all complexes Ir builderC^N familiesD-MPNN

Complex #2390 — Ru(2) [5]

2D Structure

Structure
⬇ MOL V3000

Info

ID2390
MetalRu
Oxidation state2
Charge1
Donor atoms{"N": 2}
Abbreviation5
SMILESCC(C)(C)c1ccnc(-c2cc(C(C)(C)C)ccn2)c1.Cc1ccc(C(C)C)cc1.[Cl-]

TUCAN

C28H38N2Ru/(1-40)(2-49)(3-40)(4-48)(5-40)(6-44)(7-50)(8-44)(9-51)(10-63)(11-52)(12-44)(13-54)(14-39)(15-41)(16-41)(17-41)(18-42)(19-42)(20-42)(21-43)(22-43)(23-43)(24-45)(25-53)(26-45)(27-45)(28-46)(29-39)(30-39)(31-60)(32-46)(33-46)(34-47)(35-64)(36-47)(37-55)(38-47)(39-56)(40-60)(41-61)(42-61)(43-61)(44-60)(45-62)(46-62)(47-62)(48-49)(48-56)(49-58)(50-54)(50-56)(51-57)(51-65)(52-57)(52-63)(53-59)(53-66)(54-58)(55-59)(55-64)(57-61)(58-60)(59-62)(63-67)(64-68)(65-66)(65-67)(66-68)(67-69)(68-69)

Measurements (9)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
MCF-74.3— 10.1016/j.jinorgbio.2015.07.01... 2015
MDA-MB-2316.8— 10.1016/j.jinorgbio.2015.07.01... 2015
T2412— 10.3390/ijms241511896 2023
A54918— 10.1016/j.jinorgbio.2015.07.01... 2015
HepG230— 10.3390/ijms241511896 2023
MCF-10A48— 10.3390/ijms241511896 2023
L-92990— 10.1016/j.jinorgbio.2015.07.01... 2015
Vero—— 10.3390/ijms241511896 2023
EA.hy926—— 10.3390/ijms241511896 2023

🧬 Cell Death Types (1)

Apoptosis high
«Fluorescence imaging and flow cytometry analysis demonstrate that 1 and 2 effectively penetrate the membrane and promote T24 cell death through the apoptotic pathway, mainly inducing early apoptosis o...»

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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