Info
| ID | 4024 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 1 |
| Donor atoms | {"N": 8} |
| Abbreviation | 2 |
| SMILES | COc1ccc([N-]S(=O)(=O)c2ccc(N)cc2)nn1.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12 |
TUCAN
C35H27N8O3RuS/(1-31)(2-28)(3-50)(4-30)(5-29)(6-32)(7-33)(8-36)(9-45)(10-42)(11-34)(12-51)(13-40)(14-41)(15-43)(16-52)(17-37)(18-60)(19-60)(20-39)(21-38)(22-35)(23-53)(24-44)(25-60)(26-63)(27-63)(28-29)(28-46)(29-47)(30-31)(30-46)(31-50)(32-33)(32-51)(33-47)(34-36)(34-55)(35-41)(35-55)(36-62)(37-38)(37-52)(38-48)(39-44)(39-53)(40-43)(40-48)(41-62)(42-45)(42-61)(43-49)(44-49)(45-59)(46-54)(47-56)(48-57)(49-58)(50-65)(51-66)(52-67)(53-68)(54-56)(54-65)(55-63)(56-66)(57-58)(57-67)(58-68)(59-69)(59-70)(60-73)(61-64)(61-73)(62-74)(64-69)(65-75)(66-75)(67-75)(68-75)(69-75)(70-74)(70-75)(71-74)(72-74)(73-75)(74-75)
Measurements (1)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| K-562 | 2 | — | 10.3390/molecules24112154 | 2019 |
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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