Info
| ID | 5177 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"N": 5} |
| Abbreviation | IrM4 |
| SMILES | Cn1c2ccccc2c2ccnc(-c3ccc4ccccc4n3)c21.[c-]1ccccc1-c1nccc2ccccc12.[c-]1ccccc1-c1nccc2ccccc12 |
TUCAN
C51H35IrN5/(1-39)(2-40)(3-50)(4-47)(5-49)(6-77)(7-46)(8-48)(9-45)(10-38)(11-60)(12-57)(13-66)(14-63)(15-55)(16-76)(17-76)(18-54)(19-65)(20-52)(21-44)(22-42)(23-58)(24-61)(25-41)(26-79)(27-64)(28-76)(29-53)(30-43)(31-62)(32-59)(33-51)(34-56)(35-78)(36-45)(36-69)(37-60)(37-72)(38-40)(38-70)(39-67)(39-77)(40-47)(41-47)(41-67)(42-43)(42-86)(43-44)(44-53)(45-48)(46-50)(46-69)(48-50)(49-57)(49-61)(51-68)(51-79)(52-65)(52-84)(53-75)(54-64)(54-75)(55-63)(55-65)(56-58)(56-72)(57-73)(58-62)(59-61)(59-68)(60-62)(63-74)(64-83)(66-71)(66-78)(67-70)(68-73)(69-80)(70-80)(71-74)(71-85)(72-81)(73-81)(74-84)(75-86)(76-87)(77-88)(78-89)(79-91)(80-88)(81-91)(82-83)(82-85)(82-89)(83-90)(84-87)(85-87)(86-90)(88-92)(89-92)(90-92)(91-92)
Measurements (6)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| HeLa | 0.79 | — | 10.1039/C8DT00783G | 2018 |
| A549 | 0.97 | — | 10.1039/C8DT00783G | 2018 |
| MCF-7 | 1.1 | — | 10.1039/C8DT00783G | 2018 |
| HepG2 | 1.3 | — | 10.1039/C8DT00783G | 2018 |
| A549cisR | 1.5 | — | 10.1039/C8DT00783G | 2018 |
| LO2 | 4.8 | — | 10.1039/C8DT00783G | 2018 |
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.