Info
| ID | 4744 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 1 |
| Donor atoms | {"N": 3} |
| Abbreviation | C1 |
| SMILES | Cc1ccc(C(C)C)cc1.NC(=S)Nc1ccnc2cc(Cl)ccc12.[Cl-] |
TUCAN
C20Cl2N3RuS/(1-13)(2-12)(3-12)(4-5)(4-14)(5-13)(6-18)(6-20)(7-11)(7-20)(8-16)(8-17)(9-10)(9-13)(10-14)(11-15)(12-14)(15-17)(15-18)(16-22)(17-23)(18-22)(19-21)(19-23)(19-24)(20-26)
Measurements (6)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| K-562 | 11 | — | 10.1021/acs.organomet.5b00041 | 2015 |
| EA.hy926 | 14 | — | 10.1021/acs.organomet.5b00041 | 2015 |
| MDA-MB-231 | 27 | — | 10.1021/acs.organomet.5b00041 | 2015 |
| A549 | 31 | — | 10.1021/acs.organomet.5b00041 | 2015 |
| MRC-5 | 34 | — | 10.1021/acs.organomet.5b00041 | 2015 |
| HeLa | 56 | — | 10.1021/acs.organomet.5b00041 | 2015 |
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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