Info
| ID | 523 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 0 |
| Donor atoms | {"O": 1} |
| Abbreviation | 3j |
| SMILES | Cc1ccc(C(C)C)cc1.O=c1c([O-])c(-c2cccc(Br)c2)oc2ccccc12.[Cl-] |
TUCAN
C25BrClO3Ru/(1-18)(2-17)(3-18)(4-9)(4-19)(5-8)(5-16)(6-7)(6-23)(7-10)(8-14)(9-17)(10-15)(11-16)(11-25)(12-13)(12-19)(13-17)(14-25)(15-20)(16-21)(18-19)(20-23)(20-24)(21-22)(21-28)(22-24)(22-26)(23-28)(24-27)(25-30)
Measurements (6)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| CH-1 | 2.3 | — | 10.1021/jm301376a | 2012 |
| 5637 | 5.9 | — | 10.1021/jm301376a | 2012 |
| SW480 | 7.2 | — | 10.1021/jm301376a | 2012 |
| LCLC-103H | 16 | — | 10.1021/jm301376a | 2012 |
| A549 | 17 | — | 10.1021/jm301376a | 2012 |
| DAN-G | 20 | — | 10.1021/jm301376a | 2012 |
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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