Info
| ID | 2645 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 2 |
| Donor atoms | {"N": 3} |
| Abbreviation | Ru1e |
| SMILES | Cc1cc(C)c(C[n+]2ccn(-c3cc4cccnc4c4ncccc34)c2)c(C)c1.Cc1ccc(C(C)C)cc1.[Cl-] |
TUCAN
C35H37N4Ru/(1-65)(2-40)(3-54)(4-63)(5-38)(6-39)(7-39)(8-38)(9-38)(10-72)(11-47)(12-46)(13-44)(14-42)(15-42)(16-50)(17-45)(18-40)(19-42)(20-64)(21-40)(22-41)(23-41)(24-43)(25-43)(26-51)(27-41)(28-68)(29-68)(30-66)(31-49)(32-39)(33-52)(34-53)(35-48)(36-67)(37-43)(38-63)(39-55)(40-58)(41-59)(42-63)(43-61)(44-46)(44-56)(45-50)(45-56)(46-55)(47-58)(47-61)(48-49)(48-66)(49-60)(50-55)(51-59)(51-61)(52-53)(52-67)(53-62)(54-62)(54-69)(56-63)(57-58)(57-59)(57-68)(60-69)(60-70)(62-71)(64-65)(64-73)(65-74)(66-76)(67-75)(68-74)(69-73)(70-71)(70-76)(71-75)(72-73)(72-74)(75-77)(76-77)
Measurements (3)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| MDA-MB-231 | 1.5e+02 | — | 10.1016/j.jinorgbio.2025.11293... | 2025 |
| MCF-10A | 2.5e+02 | — | 10.1016/j.jinorgbio.2025.11293... | 2025 |
| MCF-7 | 2.9e+02 | — | 10.1016/j.jinorgbio.2025.11293... | 2025 |
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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