Info
| ID | 1930 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 1 |
| Donor atoms | {"N": 4} |
| Abbreviation | 3a |
| SMILES | Cc1ccc(C(C)C)cc1.Clc1nc2ccc(/N=C/c3ccccn3)cc2c2[nH]c3ccccc3c12.[Cl-] |
TUCAN
C31H27ClN4Ru/(1-38)(2-50)(3-44)(4-39)(5-28)(6-42)(7-41)(8-43)(9-52)(10-33)(11-34)(12-35)(13-51)(14-36)(15-37)(16-31)(17-32)(18-29)(19-29)(20-29)(21-28)(22-30)(23-40)(24-30)(25-28)(26-30)(27-60)(28-46)(29-50)(30-50)(31-34)(31-56)(32-37)(32-54)(33-37)(33-52)(34-43)(35-36)(35-57)(36-53)(38-39)(38-46)(39-47)(40-44)(40-47)(41-48)(41-57)(42-43)(42-49)(44-46)(45-49)(45-55)(45-58)(47-50)(48-53)(48-55)(49-56)(51-54)(51-61)(52-59)(53-62)(54-59)(55-60)(56-60)(57-61)(58-62)(58-63)(61-64)(62-64)
Measurements (3)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| CH-1 | 1.3 | — | 10.1021/om3012272 | 2013 |
| SW480 | 17 | — | 10.1021/om3012272 | 2013 |
| A549 | 51 | — | 10.1021/om3012272 | 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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