Info
| ID | 5688 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 2 |
| Donor atoms | {"N": 4} |
| Abbreviation | Ir1 |
| SMILES | Cc1c(C)c(C)[c-](C)c1C.[Cl-].c1ccc([P+](CCCCOc2ccc(-c3nc4c5cccnc5c5ncccc5c4[nH]3)cc2)(c2ccccc2)c2ccccc2)cc1 |
TUCAN
C51H49IrN4OP/(1-68)(2-95)(3-79)(4-79)(5-95)(6-50)(7-50)(8-50)(9-51)(10-51)(11-97)(12-59)(13-58)(14-62)(15-78)(16-78)(17-63)(18-64)(19-60)(20-72)(21-77)(22-65)(23-57)(24-75)(25-88)(26-61)(27-56)(28-66)(29-89)(30-71)(31-55)(32-70)(33-67)(34-73)(35-69)(36-76)(37-74)(38-97)(39-51)(40-52)(41-52)(42-52)(43-53)(44-53)(45-53)(46-54)(47-54)(48-54)(49-102)(50-81)(51-82)(52-83)(53-84)(54-85)(55-56)(55-80)(56-88)(57-68)(57-86)(58-59)(58-62)(59-98)(60-62)(60-63)(61-64)(61-70)(63-98)(64-99)(65-66)(65-99)(66-70)(67-69)(67-100)(68-96)(69-74)(71-77)(71-86)(72-75)(72-89)(73-76)(73-100)(74-76)(75-87)(77-96)(78-79)(78-97)(79-95)(80-90)(80-93)(81-82)(81-83)(82-84)(83-85)(84-85)(86-94)(87-91)(87-92)(88-101)(89-103)(90-92)(90-102)(91-93)(91-103)(92-104)(93-101)(94-102)(94-104)(95-105)(96-105)(97-106)(98-106)(99-106)(100-106)(103-107)(104-107)(105-107)(106-107)
Measurements (3)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| A549 | 5.1 | — | 10.1021/acs.inorgchem.4c03975 | 2024 |
| HeLa | 13 | — | 10.1021/acs.inorgchem.4c03975 | 2024 |
| BEAS-2B | — | — | 10.1021/acs.inorgchem.4c03975 | 2024 |
🧬 Cell Death Types (1)
Apoptosis
high
«thereby leading to intrinsic apoptotic 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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