Info
| ID | 1898 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 1 |
| Donor atoms | {"N": 4} |
| Abbreviation | 6 |
| SMILES | Cc1ccc(C(C)C)cc1.[Cl-].c1ccc2c(c1)[nH]c1c(-c3ncc[nH]3)nccc12 |
TUCAN
C24H24N4Ru/(1-25)(2-34)(3-26)(4-33)(5-25)(6-30)(7-42)(8-32)(9-43)(10-29)(11-31)(12-44)(13-28)(14-25)(15-41)(16-26)(17-35)(18-26)(19-27)(20-36)(21-27)(22-27)(23-49)(24-50)(25-37)(26-41)(27-41)(28-31)(28-32)(29-40)(29-44)(30-31)(30-39)(32-47)(33-34)(33-37)(34-38)(35-36)(35-38)(36-37)(38-41)(39-40)(39-47)(40-46)(42-43)(42-50)(43-52)(44-51)(45-46)(45-48)(45-51)(46-49)(47-49)(48-50)(48-52)(51-53)(52-53)
Measurements (6)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| CNE-2 | 1.5 | — | 10.1002/chem.201301389 | 2013 |
| A549cisR | 1.9 | — | 10.1002/chem.201301389 | 2013 |
| HeLa | 2.4 | — | 10.1002/chem.201301389 | 2013 |
| A549 | 5.4 | — | 10.1002/chem.201301389 | 2013 |
| HepG2 | 7.5 | — | 10.1002/chem.201301389 | 2013 |
| HLF | 44 | — | 10.1002/chem.201301389 | 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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