Info
| ID | 5158 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"N": 6} |
| Abbreviation | Ir4 |
| SMILES | COc1ccc(-n2c(-c3ccc4c(c3)C(=O)c3ccccc3C4=O)nc3c4cccnc4c4ncccc4c32)cc1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1 |
TUCAN
C56H36IrN6O3/(1-77)(2-40)(3-67)(4-80)(5-63)(6-57)(7-79)(8-41)(9-46)(10-49)(11-55)(12-59)(13-54)(14-42)(15-39)(16-53)(17-62)(18-43)(19-44)(20-78)(21-47)(22-48)(23-51)(24-89)(25-89)(26-50)(27-66)(28-65)(29-45)(30-58)(31-89)(32-52)(33-60)(34-61)(35-56)(36-64)(37-40)(37-68)(38-46)(38-69)(39-42)(39-81)(40-63)(41-42)(41-77)(43-45)(43-78)(44-57)(44-68)(45-56)(46-64)(47-58)(47-69)(48-61)(48-79)(49-54)(49-80)(50-51)(50-70)(51-53)(52-71)(52-76)(53-67)(54-74)(55-59)(55-83)(56-86)(57-63)(58-64)(59-92)(60-66)(60-76)(61-72)(62-65)(62-92)(65-83)(66-73)(67-75)(68-81)(69-86)(70-75)(70-90)(71-73)(71-90)(72-82)(72-85)(73-91)(74-84)(74-87)(75-91)(76-88)(77-95)(78-96)(79-93)(80-98)(81-95)(82-84)(82-93)(83-94)(84-98)(85-87)(85-94)(86-96)(87-97)(88-94)(88-97)(89-101)(90-99)(91-100)(92-101)(95-102)(96-102)(97-102)(98-102)(101-102)
Measurements (5)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| HeLa | 2.8 | — | 10.1039/C9QI00081J | 2019 |
| A549 | 2.8 | — | 10.1039/C9QI00081J | 2019 |
| A549cisR | 2.9 | — | 10.1039/C9QI00081J | 2019 |
| HepG2 | 4.5 | — | 10.1039/C9QI00081J | 2019 |
| LO2 | 5.8 | — | 10.1039/C9QI00081J | 2019 |
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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The generated SVG will appear here. The legacy ligand image above stays visible for side-by-side review.