Info
| ID | 1131 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 1 |
| Donor atoms | {"N": 4} |
| Abbreviation | 2 |
| SMILES | Cc1ccc(C(C)C)cc1.F[B-]1(F)n2cccc2C(c2cc3ccccc3nc2-n2cccn2)=C2C=CC=[N+]21.[Cl-] |
TUCAN
C31H28BF2N5Ru/(1-30)(2-39)(3-38)(4-46)(5-30)(6-54)(7-33)(8-56)(9-55)(10-36)(11-34)(12-53)(13-44)(14-45)(15-42)(16-35)(17-41)(18-37)(19-43)(20-31)(21-31)(22-31)(23-52)(24-30)(25-40)(26-32)(27-32)(28-32)(29-61)(29-62)(29-66)(29-67)(30-48)(31-52)(32-52)(33-35)(33-54)(34-36)(34-44)(35-57)(36-47)(37-47)(37-51)(38-39)(38-48)(39-49)(40-46)(40-49)(41-42)(41-58)(42-55)(43-44)(43-59)(45-53)(45-56)(46-48)(47-59)(49-52)(50-51)(50-57)(50-58)(51-60)(53-65)(54-61)(55-62)(56-63)(57-61)(58-62)(59-64)(60-63)(60-64)(63-65)(64-68)(65-68)
Measurements (1)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| U-87 MG | — | 25 | 10.1039/c8dt02947d | 2018 |
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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