Info
| ID | 2777 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 2 |
| Donor atoms | {"N": 6} |
| Abbreviation | Ru1 |
| SMILES | O=c1[nH]c(=O)n(CCCCNc2cc3cccnc3c3ncccc23)cc1F.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1 |
TUCAN
C40H34FN9O2Ru/(1-39)(2-56)(3-40)(4-36)(5-57)(6-49)(7-51)(8-35)(9-38)(10-37)(11-41)(12-60)(13-45)(14-61)(15-52)(16-53)(17-64)(18-64)(19-53)(20-50)(21-63)(22-59)(23-47)(24-42)(25-43)(26-46)(27-58)(28-63)(29-62)(30-52)(31-44)(32-48)(33-76)(34-75)(35-36)(35-65)(36-39)(37-38)(37-40)(38-66)(39-56)(40-57)(41-42)(41-67)(42-47)(43-46)(43-71)(44-45)(44-58)(45-55)(46-48)(47-61)(48-62)(49-55)(49-70)(50-51)(50-59)(51-54)(52-53)(52-63)(53-64)(54-68)(54-70)(55-69)(56-78)(57-79)(58-82)(59-81)(60-74)(60-77)(61-80)(62-83)(63-75)(64-77)(65-66)(65-78)(66-79)(67-71)(67-80)(68-69)(68-81)(69-82)(70-75)(71-83)(72-74)(72-76)(72-85)(73-76)(73-77)(73-84)(74-86)(78-87)(79-87)(80-87)(81-87)(82-87)(83-87)
Measurements (6)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| HeLa | 53 | — | 10.1007/s00775-023-02039-5 | 2024 |
| MCF-7 | 72 | — | 10.1007/s00775-023-02039-5 | 2024 |
| A549 | 80 | — | 10.1007/s00775-023-02039-5 | 2024 |
| LO2 | 80 | — | 10.1007/s00775-023-02039-5 | 2024 |
| HepG2 | 84 | — | 10.1007/s00775-023-02039-5 | 2024 |
| Caco-2 | 1.1e+02 | — | 10.1007/s00775-023-02039-5 | 2024 |
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.