Info
| ID | 4967 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"N": 8} |
| Abbreviation | 2 |
| SMILES | FC(F)(F)c1ccc(Cn2c(-c3[c-]cccc3)nc3ccccc32)cc1.FC(F)(F)c1ccc(Cn2c(-c3[c-]cccc3)nc3ccccc32)cc1.c1cnc2c(c1)c1nccnc1c1cccnc12 |
TUCAN
C56H36F6IrN8/(1-76)(2-40)(3-61)(4-47)(5-42)(6-43)(7-46)(8-55)(9-48)(10-63)(11-54)(12-50)(13-52)(14-77)(15-75)(16-51)(17-64)(18-53)(19-56)(20-41)(21-44)(22-57)(23-78)(24-58)(25-39)(26-49)(27-59)(28-79)(29-66)(30-62)(31-79)(32-45)(33-60)(34-65)(35-80)(36-80)(37-46)(37-70)(38-60)(38-72)(39-58)(39-82)(40-61)(40-76)(41-46)(41-50)(42-52)(42-71)(43-53)(43-71)(44-55)(44-84)(45-62)(45-83)(47-50)(47-70)(48-56)(48-73)(49-57)(49-73)(51-63)(51-67)(52-68)(53-68)(54-64)(54-72)(55-58)(56-69)(57-69)(59-62)(59-66)(60-65)(61-74)(63-78)(64-65)(66-88)(67-85)(67-86)(68-91)(69-92)(70-89)(71-79)(72-90)(73-80)(74-81)(74-87)(75-77)(75-100)(76-94)(77-93)(78-97)(79-95)(80-96)(81-86)(81-93)(82-84)(82-98)(83-88)(83-99)(84-95)(85-87)(85-97)(86-100)(87-94)(88-96)(89-95)(89-98)(90-96)(90-99)(91-101)(91-102)(91-103)(92-104)(92-105)(92-106)(97-107)(98-107)(99-107)(100-107)
Measurements (5)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| A2780cisR | 0.37 | — | 10.1002/chem.201705362 | 2018 |
| MCF-7 | 0.5 | — | 10.1002/chem.201705362 | 2018 |
| HeLa | 0.9 | — | 10.1002/chem.201705362 | 2018 |
| A2780 | 1.1 | — | 10.1002/chem.201705362 | 2018 |
| MCF-10A | 3.2 | — | 10.1002/chem.201705362 | 2018 |
🧬 Cell Death Types (2)
Apoptosis
medium
«Presumably, [1a]Cl and [3a]Cl induce death on cancer cells under irradiation through apoptosis triggered by a multimodal mechanism of action, which likely involves damage over mitochondrial DNA and mi...»
Immunogenic Cell Death
low
«No explicit evidence found.»
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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