Info
| ID | 1734 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 1 |
| Donor atoms | {"N": 2} |
| Abbreviation | 532m |
| SMILES | CC(C)c1cc(C(C)C)cc(C(C)C)c1.Cc1ccc(/C=N/c2cccc(C(F)(F)F)c2)nc1.[Cl-] |
TUCAN
C29H35F3N2Ru/(1-36)(2-45)(3-37)(4-37)(5-37)(6-38)(7-57)(8-38)(9-38)(10-39)(11-39)(12-39)(13-58)(14-40)(15-46)(16-40)(17-40)(18-50)(19-36)(20-44)(21-43)(22-61)(23-60)(24-51)(25-48)(26-49)(27-36)(28-47)(29-41)(30-41)(31-41)(32-42)(33-59)(34-42)(35-42)(36-52)(37-57)(38-57)(39-58)(40-58)(41-59)(42-59)(43-50)(43-52)(44-49)(44-62)(45-53)(45-54)(46-53)(46-55)(47-54)(47-55)(48-49)(48-56)(50-63)(51-56)(51-62)(52-60)(53-57)(54-58)(55-59)(56-64)(60-66)(61-63)(61-65)(62-65)(63-66)(64-67)(64-68)(64-69)(65-70)(66-70)
Measurements (4)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| AGS | 4.1 | — | 10.1039/c7sc00497d | 2017 |
| TC7 | 8 | — | 10.1039/c7sc00497d | 2017 |
| HCT-116 p53-/- | 9.2 | — | 10.1039/c7sc00497d | 2017 |
| HCT-116 | 10 | — | 10.1039/c7sc00497d | 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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