Info
| ID | 2952 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 0 |
| Donor atoms | {"N": 1, "O": 1} |
| Abbreviation | 13a |
| SMILES | CC1Nc2ccccc2C1C([O-])=C1C(=O)c2ccccc2C1=O.Cc1ccc(C(C)C)cc1.[Cl-] |
TUCAN
C29ClNO3Ru/(1-18)(2-17)(3-17)(4-26)(5-9)(5-15)(6-11)(6-13)(7-12)(7-19)(8-16)(8-19)(9-10)(10-25)(11-20)(12-18)(13-14)(14-22)(15-23)(16-18)(17-19)(20-22)(20-27)(21-27)(21-28)(21-29)(22-28)(23-24)(23-25)(24-26)(24-29)(25-30)(26-30)(27-31)(28-33)(29-32)
Measurements (4)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| SK-OV-3 | 1e+02 | — | 10.1039/c7nj02162c | 2017 |
| OVCAR-5 | — | — | 10.1039/c7nj02162c | 2017 |
| UWB1.289 | — | — | 10.1039/c7nj02162c | 2017 |
| UWB1.289+BRCA1 | — | — | 10.1039/c7nj02162c | 2017 |
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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