Info
| ID | 3293 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | -1 |
| Donor atoms | {"O": 2, "N": 2} |
| Abbreviation | 45 |
| SMILES | O=S(=O)([O-])c1ccc(-c2ccnc3c2ccc2c(-c4ccc(S(=O)(=O)[O-])cc4)ccnc23)cc1.[Cl-].c1ccc2c(c1)CCC2 |
TUCAN
C33H24N2O6RuS2/(1-42)(2-41)(3-42)(4-41)(5-36)(6-32)(7-29)(8-33)(9-27)(10-25)(11-52)(12-43)(13-43)(14-26)(15-30)(16-35)(17-28)(18-31)(19-37)(20-53)(21-38)(22-34)(23-40)(24-39)(25-29)(25-48)(26-27)(26-44)(27-31)(28-33)(28-48)(29-56)(30-31)(30-45)(32-47)(32-52)(33-56)(34-38)(34-57)(35-49)(35-53)(36-37)(36-46)(37-50)(38-51)(39-40)(39-57)(40-51)(41-42)(41-44)(42-43)(43-45)(44-45)(46-47)(46-54)(47-48)(49-50)(49-51)(50-55)(52-58)(53-59)(54-55)(54-58)(55-59)(56-66)(57-67)(58-68)(59-68)(60-66)(61-66)(62-66)(63-67)(64-67)(65-67)(66-68)(67-68)
Measurements (1)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| A2780 | — | — | 10.1021/jm060596m | 2006 |
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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