Info
| ID | 5858 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"N": 5} |
| Abbreviation | 3 |
| SMILES | Cc1c(C)c(C)[c-](C)c1C.[c-]1cccc2c1c1ncccc1c1nc3ccccc3nc21.c1c[nH]cn1 |
TUCAN
C32H29IrN5/(1-44)(2-42)(3-30)(4-30)(5-30)(6-31)(7-31)(8-53)(9-43)(10-55)(11-39)(12-36)(13-41)(14-40)(15-31)(16-32)(17-32)(18-32)(19-33)(20-33)(21-33)(22-34)(23-34)(24-38)(25-37)(26-54)(27-61)(28-34)(29-63)(30-47)(31-48)(32-49)(33-50)(34-51)(35-42)(35-45)(36-37)(36-53)(37-52)(38-39)(38-41)(39-59)(40-41)(40-56)(42-44)(43-44)(43-46)(45-46)(45-57)(46-58)(47-48)(47-49)(48-50)(49-51)(50-51)(52-57)(52-60)(53-64)(54-55)(54-66)(55-63)(56-59)(56-62)(57-64)(58-60)(58-62)(59-65)(60-65)(61-63)(61-66)(64-67)(65-67)(66-67)
Measurements (2)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| A549 | 4.9 | 1.2 | 10.1021/acs.jmedchem.3c01276 | 2024 |
| A549 | 4.9 | 2.5 | 10.1021/acs.jmedchem.3c01276 | 2024 |
🧬 Cell Death Types (1)
Apoptosis
high
«Consequently, cell death by apoptosis and secondary necrosis is activated.»
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.
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