Info
| ID | 112 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 0 |
| Donor atoms | {"O": 1, "N": 2} |
| Abbreviation | 3 |
| SMILES | [Cl-].[O-]/C(=N\N=C/c1cccs1)c1ccc(Br)cc1.c1ccccc1 |
TUCAN
C18H14BrN2ORuS/(1-15)(2-16)(3-17)(4-21)(5-26)(6-18)(7-23)(8-19)(9-20)(10-25)(11-30)(12-22)(13-24)(14-28)(15-16)(15-17)(16-18)(17-19)(18-20)(19-20)(21-23)(21-32)(22-24)(22-30)(23-27)(24-31)(25-26)(25-27)(26-32)(27-29)(28-31)(28-34)(29-33)(29-35)(30-36)(31-36)(32-37)(33-34)(33-38)(34-38)(36-38)
Measurements (4)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| MDA-MB-231 | 19 | — | 10.1016/j.jorganchem.2018.01.0... | 2018 |
| HepG2 | 22 | — | 10.1016/j.jorganchem.2018.01.0... | 2018 |
| HeLa | 31 | — | 10.1016/j.jorganchem.2018.01.0... | 2018 |
| NIH-3T3 | 2.4e+02 | — | 10.1016/j.jorganchem.2018.01.0... | 2018 |
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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