Info
| ID | 5478 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"N": 5} |
| Abbreviation | 2 |
| SMILES | Cc1c[c-]c(-c2ccccn2)cc1.Cc1c[c-]c(-c2ccccn2)cc1.Clc1cc(-c2ccccn2)nc(-c2ccccn2)c1 |
TUCAN
C39H30ClIrN5/(1-43)(2-31)(3-37)(4-60)(5-40)(6-41)(7-44)(8-31)(9-31)(10-32)(11-45)(12-42)(13-35)(14-53)(15-38)(16-54)(17-32)(18-36)(19-46)(20-51)(21-49)(22-32)(23-48)(24-61)(25-47)(26-50)(27-59)(28-39)(29-62)(30-52)(31-56)(32-58)(33-43)(33-55)(34-52)(34-57)(35-40)(35-60)(36-63)(36-69)(37-42)(37-48)(38-41)(38-55)(39-44)(39-62)(40-53)(41-56)(42-68)(43-56)(44-54)(45-50)(45-58)(46-51)(46-59)(47-51)(47-64)(48-61)(49-67)(49-69)(50-57)(52-58)(53-65)(54-66)(55-65)(57-66)(59-71)(60-72)(61-70)(62-74)(63-68)(63-73)(64-67)(64-71)(65-72)(66-74)(67-73)(68-70)(69-75)(71-76)(72-76)(73-76)(74-76)
Measurements (2)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| MCF-7 | 1.8 | — | 10.1002/zaac.202200047 | 2022 |
| HT-29 | 3.2 | — | 10.1002/zaac.202200047 | 2022 |
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.