Info
| ID | 5048 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 2 |
| Donor atoms | {"N": 6} |
| Abbreviation | 2 |
| SMILES | Cc1c[c-]c(-c2ccccn2)cc1.Cc1c[c-]c(-c2ccccn2)cc1.NC(=[NH2+])Nc1cccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)c1 |
TUCAN
C44H36IrN9/(1-37)(2-48)(3-46)(4-41)(5-45)(6-69)(7-37)(8-37)(9-71)(10-38)(11-47)(12-51)(13-42)(14-54)(15-38)(16-53)(17-52)(18-44)(19-70)(20-57)(21-50)(22-49)(23-43)(24-68)(25-56)(26-58)(27-60)(28-59)(29-55)(30-38)(31-81)(32-81)(33-85)(34-84)(35-82)(36-82)(37-65)(38-66)(39-46)(39-64)(40-60)(40-67)(41-47)(41-69)(42-48)(42-65)(43-53)(43-68)(44-52)(44-62)(45-51)(45-63)(46-65)(47-57)(48-64)(49-62)(49-76)(50-52)(50-76)(51-70)(53-61)(54-55)(54-71)(55-58)(56-59)(56-66)(57-73)(58-74)(59-67)(60-66)(61-72)(61-75)(62-79)(63-77)(63-78)(64-73)(67-74)(68-87)(69-86)(70-83)(71-89)(72-78)(72-87)(73-86)(74-89)(75-77)(75-88)(76-85)(77-84)(78-83)(79-84)(79-88)(80-81)(80-82)(80-85)(86-90)(87-90)(88-90)(89-90)
Measurements (7)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| A549cisR | 18 | — | 10.1016/j.ejmech.2017.06.038 | 2017 |
| MCF-7 | 23 | — | 10.1016/j.ejmech.2017.06.038 | 2017 |
| CNE-2 | 30 | — | 10.1016/j.ejmech.2017.06.038 | 2017 |
| A549 | 31 | — | 10.1016/j.ejmech.2017.06.038 | 2017 |
| HeLa | 34 | — | 10.1016/j.ejmech.2017.06.038 | 2017 |
| LO2 | 50 | — | 10.1016/j.ejmech.2017.06.038 | 2017 |
| HepG2 | 58 | — | 10.1016/j.ejmech.2017.06.038 | 2017 |
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.