home← all complexes Ir builderC^N familiesD-MPNN

Complex #6889 — Rh(3) [5]

2D Structure

Structure
⬇ MOL V3000

Info

ID6889
MetalRh
Oxidation state3
Charge0
Donor atoms{"N": 7}
Abbreviation5
SMILESCC#N.Cc1cc(-c2ccccc2)n2nc3nc(-n4nc(C)cc4-c4ccccc4)cc(C)c3c2n1.[Cl-].[Cl-].[Cl-]

TUCAN

C29H25N7Rh/(1-41)(2-30)(3-29)(4-29)(5-29)(6-39)(7-27)(8-28)(9-42)(10-26)(11-26)(12-34)(13-26)(14-32)(15-31)(16-33)(17-28)(18-27)(19-28)(20-40)(21-27)(22-37)(23-38)(24-36)(25-35)(26-44)(27-49)(28-51)(29-47)(30-34)(30-35)(31-44)(31-53)(32-34)(32-43)(33-35)(33-43)(36-48)(36-51)(37-49)(37-50)(38-41)(38-42)(39-41)(39-46)(40-42)(40-46)(43-48)(44-45)(45-52)(45-54)(46-50)(47-55)(48-58)(49-56)(50-59)(51-57)(52-56)(52-59)(53-58)(53-60)(54-60)(54-61)(57-58)(59-61)(60-62)(61-62)

Measurements (7)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
T242.1— 10.1016/j.bioorg.2023.106838 2023
HL-77022.5— 10.1016/j.bioorg.2023.106838 2023
WI-383.2— 10.1016/j.bioorg.2023.106838 2023
HeLa4.2— 10.1016/j.bioorg.2023.106838 2023
A5494.5— 10.1016/j.bioorg.2023.106838 2023
BEL-74045.7— 10.1016/j.bioorg.2023.106838 2023
SK-OV-35.8— 10.1016/j.bioorg.2023.106838 2023

🧬 Cell Death Types (1)

Apoptosis high
«Mechanism studies indicated that complexes 5 and 6 induced G2/M phase cell cycle arrest through DNA damage, and induced apoptosis via endoplasmic reticulum stress response. In addition, complex 5 also...»

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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