Info
| ID | 3336 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 0 |
| Donor atoms | {"N": 2} |
| Abbreviation | Neutral Ru(II) 6e |
| SMILES | CON=C1C(c2[c-]cc(F)cc2)=Nc2cc(OC)c(OC)cc21.Cc1ccc(C(C)C)cc1.[Cl-] |
TUCAN
C27H28FN2O3Ru/(1-34)(2-38)(3-29)(4-30)(5-30)(6-50)(7-29)(8-33)(9-36)(10-29)(11-31)(12-31)(13-35)(14-46)(15-31)(16-30)(17-39)(18-40)(19-52)(20-52)(21-52)(22-41)(23-51)(24-51)(25-50)(26-37)(27-51)(28-50)(29-46)(30-42)(31-46)(32-40)(32-45)(33-34)(33-42)(34-44)(35-38)(35-42)(36-43)(36-54)(37-47)(37-53)(38-44)(39-41)(39-55)(40-55)(41-45)(43-47)(43-49)(44-46)(45-48)(47-56)(48-49)(48-56)(49-57)(50-58)(51-59)(52-60)(53-54)(53-58)(54-59)(55-61)(56-62)(57-60)(57-62)
Measurements (2)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| MDA-MB-231 | 3.2 | — | 10.1021/om400941b | 2013 |
| MCF-7 | 3.7 | — | 10.1021/om400941b | 2013 |
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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