Info
| ID | 2036 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 1 |
| Donor atoms | {"N": 3} |
| Abbreviation | 3 |
| SMILES | Cc1ccc(C(C)C)cc1.S=C(N/N=C/c1ccccc1)Nc1ccccc1.[Cl-] |
TUCAN
C24ClN3RuS/(1-18)(2-19)(3-19)(4-7)(4-21)(5-8)(5-18)(6-7)(6-13)(8-20)(9-10)(9-15)(10-11)(11-17)(12-13)(12-21)(14-16)(14-18)(15-23)(16-20)(17-23)(19-20)(21-22)(22-26)(23-25)(24-25)(24-27)(24-28)(26-27)
Measurements (7)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| SK-BR-3 | 10 | — | 10.1002/aoc.2977 | 2013 |
| CNE-1 | 20 | — | 10.1002/aoc.2977 | 2013 |
| SGC-7901 | 20 | — | 10.1016/j.jorganchem.2014.12.0... | 2015 |
| NCI-H292 | 31 | — | 10.1002/aoc.2977 | 2013 |
| BEL-7404 | 32 | — | 10.1016/j.jorganchem.2014.12.0... | 2015 |
| Hey1-B | 35 | — | 10.1002/aoc.2977 | 2013 |
| HEK293T | 44 | — | 10.1016/j.jorganchem.2014.12.0... | 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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