Info
| ID | 5424 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 0 |
| Donor atoms | {"O": 1, "N": 2} |
| Abbreviation | 1 |
| SMILES | CC(C)(C)C(=O)/C=C(\[O-])C(C)(C)C.[c-]1ccccc1-c1nccc2ccccc12.[c-]1ccccc1-c1nccc2ccccc12 |
TUCAN
C41H39IrN2O2/(1-51)(2-50)(3-75)(4-59)(5-40)(6-40)(7-40)(8-41)(9-41)(10-61)(11-60)(12-49)(13-52)(14-48)(15-55)(16-76)(17-62)(18-41)(19-42)(20-42)(21-42)(22-43)(23-43)(24-43)(25-66)(26-57)(27-64)(28-56)(29-63)(30-54)(31-58)(32-65)(33-44)(34-44)(35-44)(36-45)(37-45)(38-53)(39-45)(40-73)(41-73)(42-73)(43-74)(44-74)(45-74)(46-61)(46-71)(47-63)(47-72)(48-49)(48-59)(49-68)(50-59)(50-67)(51-68)(51-75)(52-60)(52-71)(53-79)(53-80)(54-62)(54-69)(55-60)(55-61)(56-65)(56-70)(57-70)(57-76)(58-64)(58-72)(62-65)(63-66)(64-66)(67-68)(67-77)(69-70)(69-78)(71-77)(72-78)(73-79)(74-80)(75-81)(76-82)(77-81)(78-82)(79-83)(80-84)(81-85)(82-85)
Measurements (1)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| PC-3 | — | 6 | 10.1007/s00775-020-01761-8 | 2020 |
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.