Info
| ID | 6106 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"N": 7} |
| Abbreviation | Ir3 |
| SMILES | O=C(Nc1cc2cccnc2c2ncccc12)c1cc2c([nH]c3ccccc32)c(-c2ccccc2)n1.[c-]1cccc2ccc3cccnc3c12.[c-]1cccc2ccc3cccnc3c12 |
TUCAN
C56H35IrN7O/(1-78)(2-41)(3-42)(4-45)(5-44)(6-81)(7-65)(8-40)(9-62)(10-47)(11-51)(12-66)(13-56)(14-57)(15-49)(16-38)(17-58)(18-80)(19-50)(20-55)(21-54)(22-48)(23-39)(24-46)(25-61)(26-79)(27-63)(28-53)(29-52)(30-60)(31-64)(32-43)(33-59)(34-93)(35-94)(36-38)(36-67)(37-60)(37-71)(38-40)(39-43)(39-68)(40-41)(41-70)(42-48)(42-76)(43-70)(44-45)(44-78)(45-68)(46-59)(46-69)(47-65)(47-69)(48-60)(49-51)(49-77)(50-53)(50-63)(51-52)(52-54)(53-55)(54-64)(55-73)(56-58)(56-79)(57-66)(57-80)(58-74)(59-76)(61-74)(61-87)(62-72)(62-89)(63-90)(64-77)(65-81)(66-75)(67-70)(67-82)(68-82)(69-85)(71-76)(71-85)(72-73)(72-84)(73-90)(74-86)(75-87)(75-88)(77-83)(78-95)(79-98)(80-96)(81-97)(82-95)(83-84)(83-92)(84-93)(85-97)(86-88)(86-98)(87-94)(88-96)(89-91)(89-92)(90-93)(91-94)(91-99)(95-100)(96-100)(97-100)(98-100)
Measurements (5)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| A549 | 0.5 | — | 10.1093/mtomcs/mfad035 | 2023 |
| HeLa | 1.1 | — | 10.1093/mtomcs/mfad035 | 2023 |
| HepG2 | 1.6 | — | 10.1093/mtomcs/mfad035 | 2023 |
| MCF-7 | 3.7 | — | 10.1093/mtomcs/mfad035 | 2023 |
| BEAS-2B | 7.5 | — | 10.1093/mtomcs/mfad035 | 2023 |
🧬 Cell Death Types (1)
Apoptosis
high
«the activation of intracellular caspase pathway and apoptosis was further validated to contribute to iridium complexes-induced cytotoxicity»
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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