Info
| ID | 5997 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 2 |
| Donor atoms | {"N": 6} |
| Abbreviation | Ir4 |
| SMILES | Fc1[c-]c(-c2ccccn2)cc(F)c1.Fc1[c-]c(-c2ccccn2)cc(F)c1.c1ccc([P+](CCCCOc2ccc(-c3nc4c5cccnc5c5ncccc5c4[nH]3)cc2)(c2ccccc2)c2ccccc2)cc1 |
TUCAN
C63H46F4IrN6OP/(1-54)(2-90)(3-82)(4-106)(5-62)(6-64)(7-49)(8-91)(9-72)(10-61)(11-65)(12-82)(13-52)(14-69)(15-89)(16-60)(17-76)(18-78)(19-71)(20-51)(21-63)(22-55)(23-50)(24-68)(25-59)(26-75)(27-56)(28-66)(29-100)(30-106)(31-67)(32-100)(33-83)(34-73)(35-70)(36-83)(37-74)(38-57)(39-81)(40-53)(41-58)(42-80)(43-77)(44-92)(45-79)(46-111)(47-85)(47-103)(48-86)(48-104)(49-54)(49-107)(50-51)(50-87)(51-101)(52-62)(52-107)(53-58)(53-78)(54-61)(55-64)(55-84)(56-57)(56-101)(57-87)(58-93)(59-65)(59-88)(60-63)(60-108)(61-62)(63-69)(64-89)(65-90)(66-68)(66-108)(67-70)(67-109)(68-69)(70-75)(71-85)(71-102)(72-102)(72-103)(73-74)(73-109)(74-75)(76-104)(76-105)(77-86)(77-105)(78-91)(79-80)(79-81)(80-94)(81-92)(82-83)(82-100)(83-106)(84-96)(84-97)(85-93)(86-94)(87-99)(88-95)(88-98)(89-110)(90-112)(91-114)(92-115)(93-114)(94-115)(95-96)(95-112)(96-110)(97-98)(97-111)(98-113)(99-111)(99-113)(100-116)(101-116)(102-118)(103-117)(104-120)(105-119)(106-121)(107-121)(108-121)(109-121)(112-122)(113-122)(114-122)(115-122)(116-122)(121-122)
Measurements (3)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| HeLa | 3.7 | — | 10.1016/j.bioorg.2025.108148 | 2025 |
| A549 | 7.3 | — | 10.1016/j.bioorg.2025.108148 | 2025 |
| BEAS-2B | 43 | — | 10.1016/j.bioorg.2025.108148 | 2025 |
🧬 Cell Death Types (1)
Apoptosis
high
«Mechanistic studies confirmed that these complexes selectively target mitochondria ... leading to ... activation of intrinsic apoptosis pathways.»
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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