Info
| ID | 4837 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"N": 8} |
| Abbreviation | 1c |
| SMILES | FC(F)(F)c1ccc(Cn2c(-c3[c-]cccc3)nc3ccccc32)cc1.FC(F)(F)c1ccc(Cn2c(-c3[c-]cccc3)nc3ccccc32)cc1.c1ccc2nc3c4cccnc4c4ncccc4c3nc2c1 |
TUCAN
C60H38F6IrN8/(1-52)(2-49)(3-53)(4-54)(5-68)(6-45)(7-63)(8-42)(9-41)(10-67)(11-48)(12-55)(13-59)(14-69)(15-81)(16-82)(17-56)(18-71)(19-46)(20-44)(21-60)(22-43)(23-47)(24-83)(25-62)(26-50)(27-57)(28-83)(29-84)(30-65)(31-58)(32-66)(33-61)(34-64)(35-84)(36-72)(37-51)(38-70)(39-41)(39-78)(40-59)(40-79)(41-47)(42-65)(42-89)(43-56)(43-80)(44-45)(44-85)(45-48)(46-47)(46-68)(48-55)(49-53)(49-73)(50-58)(50-62)(51-57)(51-72)(52-66)(52-86)(53-81)(54-63)(54-74)(55-87)(56-82)(57-59)(58-61)(60-67)(60-74)(61-88)(62-91)(63-75)(64-69)(64-76)(65-66)(67-75)(68-78)(69-77)(70-71)(70-76)(71-77)(72-79)(73-92)(73-94)(74-97)(75-83)(76-98)(77-84)(78-95)(79-96)(80-90)(80-93)(81-99)(82-103)(83-101)(84-102)(85-87)(85-101)(86-89)(86-100)(87-104)(88-91)(88-106)(89-105)(90-92)(90-103)(91-102)(92-99)(93-94)(93-105)(94-100)(95-101)(95-104)(96-102)(96-106)(97-107)(97-108)(97-109)(98-110)(98-111)(98-112)(103-113)(104-113)(105-113)(106-113)
Measurements (6)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| A2780cisR | 2.8 | — | 10.1002/chem.201705362 | 2018 |
| A2780 | 2.9 | — | 10.1002/chem.201705362 | 2018 |
| HeLa | 6.1 | — | 10.1002/chem.201705362 | 2018 |
| MCF-7 | 6.3 | — | 10.1002/chem.201705362 | 2018 |
| MCF-10A | 9.9 | — | 10.1002/chem.201705362 | 2018 |
| HeLa | — | 0.87 | 10.1039/C9QI00811J | 2019 |
🧬 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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