Info
| ID | 4874 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"N": 5} |
| Abbreviation | [1a]Cl |
| SMILES | O=C(Cn1c(-c2cscn2)nc2ccccc21)c1ccccc1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1 |
TUCAN
C40H29IrN5OS/(1-33)(2-39)(3-58)(4-43)(5-34)(6-35)(7-51)(8-32)(9-40)(10-69)(11-68)(12-49)(13-53)(14-42)(15-41)(16-48)(17-59)(18-45)(19-46)(20-36)(21-60)(22-47)(23-50)(24-54)(25-44)(26-37)(27-52)(28-38)(29-60)(30-43)(30-55)(31-52)(31-56)(32-36)(32-39)(33-34)(33-58)(34-35)(35-62)(36-55)(37-38)(37-56)(38-46)(39-43)(40-41)(40-57)(41-54)(42-47)(42-61)(44-51)(44-59)(45-51)(45-63)(46-52)(47-53)(48-50)(48-54)(49-53)(49-65)(50-57)(55-62)(56-63)(57-67)(58-71)(59-72)(60-67)(60-70)(61-65)(61-70)(62-71)(63-72)(64-66)(64-68)(64-74)(65-73)(66-70)(66-73)(67-75)(68-76)(69-74)(69-76)(71-77)(72-77)(73-77)(74-77)(76-77)
Measurements (2)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| SK-MEL-28 | 1.2 | 0.05 | 10.1016/j.jinorgbio.2022.11179... | 2022 |
| PC-3 | 2.8 | 0.32 | 10.1016/j.jinorgbio.2022.11179... | 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.
Loading source metadata…
The generated SVG will appear here. The legacy ligand image above stays visible for side-by-side review.