Info
| ID | 1399 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 0 |
| Donor atoms | {"O": 1, "N": 1} |
| Abbreviation | 3c |
| SMILES | Cc1ccc(C(C)C)cc1.[I-].[O-]c1c(Br)cc(Br)c2cccnc12 |
TUCAN
C19Br2INORu/(1-12)(2-11)(3-11)(4-5)(4-12)(5-13)(6-9)(6-12)(7-10)(7-14)(8-18)(8-19)(9-13)(10-15)(11-13)(14-16)(14-18)(15-20)(16-17)(16-20)(17-19)(17-21)(18-22)(19-23)
Measurements (10)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| NCI-H460 | 5.5 | — | 10.1021/acs.organomet.5b00868 | 2015 |
| SK-OV-3 | 6.8 | — | 10.1039/c9dt00866g | 2019 |
| HCT-116 | 7.3 | — | 10.1021/acs.organomet.5b00868 | 2015 |
| MG-63 | 8 | — | 10.1016/j.jinorgbio.2018.05.00... | 2018 |
| SiHa | 8.9 | — | 10.1021/acs.organomet.5b00868 | 2015 |
| HeLa | 8.9 | — | 10.1039/c9dt00866g | 2019 |
| MRC-5 | 15 | — | 10.1016/j.jinorgbio.2018.05.00... | 2018 |
| A549 | 19 | — | 10.1016/j.jinorgbio.2018.05.00... | 2018 |
| T24 | 33 | — | 10.1039/c9dt00866g | 2019 |
| HL-7702 | 66 | — | 10.1039/c9dt00866g | 2019 |
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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