Info
| ID | 5509 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"N": 6} |
| Abbreviation | 2 |
| SMILES | COc1ccc(OC)c2nc3c4cccnc4c4ncccc4c3nc12.[c-]1cccc2ccc3cccnc3c12.[c-]1cccc2ccc3cccnc3c12 |
TUCAN
C46H30IrN6O2/(1-33)(2-61)(3-34)(4-46)(5-39)(6-37)(7-36)(8-47)(9-38)(10-74)(11-48)(12-74)(13-74)(14-73)(15-73)(16-41)(17-63)(18-52)(19-49)(20-35)(21-50)(22-51)(23-73)(24-43)(25-64)(26-42)(27-44)(28-62)(29-40)(30-45)(31-37)(31-53)(32-44)(32-57)(33-34)(33-61)(34-54)(35-39)(35-55)(36-46)(36-62)(37-38)(38-40)(39-54)(40-55)(41-43)(41-64)(42-52)(42-63)(43-58)(44-49)(45-49)(45-56)(46-60)(47-50)(47-60)(48-51)(48-76)(50-56)(51-75)(52-59)(53-55)(53-65)(54-65)(56-57)(57-70)(58-69)(58-72)(59-67)(59-68)(60-70)(61-79)(62-80)(63-78)(64-82)(65-79)(66-71)(66-76)(66-77)(67-69)(67-78)(68-72)(68-77)(69-82)(70-80)(71-75)(71-81)(72-81)(73-84)(74-83)(75-84)(76-83)(79-85)(80-85)(81-85)(82-85)(83-85)(84-85)
Measurements (7)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| SGC-7901 | 0.7 | — | 10.1039/c9nj01001g | 2019 |
| LO2 | 1.6 | — | 10.1039/c9nj01001g | 2019 |
| A549 | 1.8 | — | 10.1039/c9nj01001g | 2019 |
| EC109 | 2.1 | — | 10.1039/c9nj01001g | 2019 |
| BEL-7402 | 2.1 | — | 10.1039/c9nj01001g | 2019 |
| HepG2 | 2.8 | — | 10.1039/c9nj01001g | 2019 |
| HeLa | 14 | — | 10.1039/c9nj01001g | 2019 |
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.