Info
| ID | 498 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 0 |
| Donor atoms | {"O": 2, "N": 2} |
| Abbreviation | 1a |
| SMILES | CC1=C([O-])C([O-])(n2cccn2)c2ccccc2C1=O.Cc1ccc(C(C)C)cc1 |
TUCAN
C24N2O3Ru/(1-15)(2-18)(3-15)(4-19)(5-7)(5-18)(6-8)(6-18)(7-17)(8-17)(9-12)(9-14)(10-13)(10-16)(11-20)(11-21)(12-13)(14-16)(14-23)(15-17)(16-24)(19-22)(19-23)(20-25)(21-26)(22-24)(22-28)(23-27)(24-26)(24-29)(25-26)
Measurements (9)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| SW480 | 0.094 | — | 10.1039/C9DT04462K | 2020 |
| SW480 | 0.094 | — | 10.3390/pharmaceutics14112466 | 2022 |
| SW480 | 0.46 | — | 10.3390/pharmaceutics14112466 | 2022 |
| A549 | 1.2 | — | 10.1039/C9DT04462K | 2020 |
| A549 | 1.2 | — | 10.3390/pharmaceutics14112466 | 2022 |
| A549 | 3.8 | — | 10.3390/pharmaceutics14112466 | 2022 |
| CH1/PA-1 | 59 | — | 10.3390/pharmaceutics14112466 | 2022 |
| CH1/PA-1 | — | — | 10.1039/C9DT04462K | 2020 |
| CH1/PA-1 | — | — | 10.3390/pharmaceutics14112466 | 2022 |
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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