Info
| ID | 5533 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"N": 6} |
| Abbreviation | Ir-1 |
| SMILES | O=Cc1ccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)cc1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1 |
TUCAN
C42H28IrN6O/(1-59)(2-35)(3-61)(4-34)(5-36)(6-48)(7-31)(8-42)(9-43)(10-37)(11-45)(12-70)(13-51)(14-39)(15-62)(16-40)(17-52)(18-38)(19-44)(20-49)(21-41)(22-60)(23-46)(24-32)(25-50)(26-47)(27-33)(28-72)(29-35)(29-53)(30-48)(30-54)(31-34)(31-38)(32-37)(32-53)(33-44)(33-54)(34-59)(35-42)(36-43)(36-61)(37-42)(38-63)(39-41)(39-60)(40-46)(40-58)(41-56)(43-49)(44-50)(45-51)(45-57)(46-62)(47-52)(47-57)(48-50)(49-64)(51-55)(52-55)(53-63)(54-64)(55-69)(56-66)(56-68)(57-70)(58-65)(58-67)(59-73)(60-74)(61-75)(62-71)(63-73)(64-75)(65-66)(65-71)(66-74)(67-68)(67-72)(68-76)(69-72)(69-76)(70-77)(73-78)(74-78)(75-78)(76-78)
Measurements (8)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| PC-12 | 1.1e+02 | 92 | 10.1039/C7RA00732A | 2017 |
| SGC-7901 | — | 6.1 | 10.1039/C7RA00732A | 2017 |
| SiHa | — | 39 | 10.1039/C7RA00732A | 2017 |
| HepG2 | — | — | 10.1039/C7RA00732A | 2017 |
| BEL-7402 | — | 36 | 10.1039/C7RA00732A | 2017 |
| A549 | — | 23 | 10.1039/C7RA00732A | 2017 |
| HeLa | — | — | 10.1039/C7RA00732A | 2017 |
| LO2 | — | 54 | 10.1039/C7RA00732A | 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.