Info
| ID | 5427 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"N": 8} |
| Abbreviation | 3 |
| SMILES | Nc1nc(N)nc(-c2ccccn2)n1.[c-]1ccccc1-c1nccc2ccccc12.[c-]1ccccc1-c1nccc2ccccc12 |
TUCAN
C38H28IrN8/(1-34)(2-42)(3-40)(4-32)(5-36)(6-44)(7-49)(8-47)(9-58)(10-33)(11-37)(12-60)(13-39)(14-31)(15-59)(16-35)(17-48)(18-46)(19-38)(20-41)(21-43)(22-45)(23-50)(24-51)(25-68)(26-67)(27-68)(28-67)(29-42)(29-53)(30-45)(30-56)(31-39)(31-44)(32-34)(32-42)(33-55)(33-58)(34-36)(35-45)(35-49)(36-53)(37-46)(37-60)(38-57)(38-59)(39-55)(40-44)(40-52)(41-50)(41-57)(43-49)(43-56)(46-51)(47-48)(47-54)(48-50)(51-62)(52-55)(52-61)(53-61)(54-57)(54-63)(56-63)(58-71)(59-73)(60-69)(61-71)(62-64)(62-69)(63-73)(64-70)(64-72)(65-67)(65-70)(65-74)(66-68)(66-72)(66-74)(71-75)(72-75)(73-75)(74-75)
Measurements (7)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| A549 | 5.6 | — | 10.1007/s00775-018-1635-8 | 2018 |
| SGC-7901 | 7.6 | — | 10.1007/s00775-018-1635-8 | 2018 |
| LO2 | 9 | — | 10.1007/s00775-018-1635-8 | 2018 |
| BEL-7402 | 9.7 | — | 10.1007/s00775-018-1635-8 | 2018 |
| EC109 | 10 | — | 10.1007/s00775-018-1635-8 | 2018 |
| HepG2 | 12 | — | 10.1007/s00775-018-1635-8 | 2018 |
| HeLa | 29 | — | 10.1007/s00775-018-1635-8 | 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.