Info
| ID | 6031 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"N": 4} |
| Abbreviation | Ir1 |
| SMILES | CC(C)(C)c1cc(-c2nc3ccccc3s2)[c-]c(-c2nc3ccccc3s2)c1.[Cl-].c1ccc(-c2ccccn2)nc1 |
TUCAN
C34H27IrN4S2/(1-28)(2-28)(3-38)(4-35)(5-33)(6-42)(7-28)(8-29)(9-32)(10-52)(11-29)(12-43)(13-44)(14-37)(15-29)(16-30)(17-39)(18-53)(19-36)(20-46)(21-30)(22-40)(23-41)(24-30)(25-47)(26-34)(27-45)(28-51)(29-51)(30-51)(31-48)(31-50)(32-48)(32-49)(33-35)(33-52)(34-35)(34-54)(36-49)(36-50)(37-38)(37-42)(38-55)(39-42)(39-58)(40-47)(40-57)(41-46)(41-59)(43-44)(43-53)(44-45)(45-56)(46-47)(48-60)(49-51)(50-61)(52-62)(53-63)(54-56)(54-62)(55-58)(55-64)(56-63)(57-59)(57-65)(58-66)(59-67)(60-64)(60-66)(61-65)(61-67)(62-68)(63-68)(64-68)(65-68)
Measurements (5)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| RKO | 0.94 | — | 10.1016/j.bioorg.2025.108507 | 2025 |
| MGC-803 | 1.1 | — | 10.1016/j.bioorg.2025.108507 | 2025 |
| HeLa | 3 | — | 10.1016/j.bioorg.2025.108507 | 2025 |
| A549 | 3.3 | — | 10.1016/j.bioorg.2025.108507 | 2025 |
| BEAS-2B | 46 | — | 10.1016/j.bioorg.2025.108507 | 2025 |
🧬 Cell Death Types (1)
Apoptosis
high
«The anticancer mechanism has been explored through apoptosis, cell cycle arrest, western blotting (WB), reactive oxygen species (ROS) levels and mitochondrial membrane potential (MMP) changes.»
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.
Loading source metadata…
The generated SVG will appear here. The legacy ligand image above stays visible for side-by-side review.