Info
| ID | 378 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 0 |
| Donor atoms | {"N": 2} |
| Abbreviation | C3 |
| SMILES | CNC(=O)c1cccc(N)c1.Cc1ccccc1.[Cl-].[Cl-] |
TUCAN
C15Cl2N2ORu/(1-11)(2-4)(2-8)(3-4)(3-11)(5-12)(5-14)(6-7)(6-9)(7-14)(8-10)(9-12)(10-11)(12-15)(13-17)(14-16)(15-17)(15-18)
Measurements (6)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| HCC1937 | 2.4e+02 | — | 10.1016/j.jinorgbio.2020.11115... | 2020 |
| MCF-7 | 2.7e+02 | — | 10.1016/j.jinorgbio.2020.11115... | 2020 |
| MDA-MB-231 | 3.1e+02 | — | 10.1016/j.jinorgbio.2020.11115... | 2020 |
| BEAS-2B | 3.5e+02 | — | 10.1016/j.jinorgbio.2020.11115... | 2020 |
| MDA-MB-361 | 4.6e+02 | — | 10.1016/j.jinorgbio.2020.11115... | 2020 |
| MDA-MB-453 | 4.9e+02 | — | 10.1016/j.jinorgbio.2020.11115... | 2020 |
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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