Info
| ID | 3434 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 0 |
| Donor atoms | {"O": 2, "N": 4} |
| Abbreviation | 1 |
| SMILES | O=C([O-])c1ccccc1[O-].c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12 |
TUCAN
C31H20N4O3Ru/(1-42)(2-23)(3-25)(4-26)(5-43)(6-31)(7-28)(8-30)(9-21)(10-44)(11-32)(12-33)(13-22)(14-35)(15-24)(16-34)(17-29)(18-45)(19-36)(20-27)(21-22)(21-37)(22-38)(23-26)(23-42)(24-29)(24-39)(25-31)(25-43)(26-37)(27-28)(27-36)(28-41)(29-40)(30-33)(30-44)(31-38)(32-34)(32-45)(33-39)(34-40)(35-36)(35-50)(37-46)(38-47)(39-48)(40-49)(41-50)(41-51)(42-52)(43-53)(44-54)(45-55)(46-47)(46-52)(47-53)(48-49)(48-54)(49-55)(50-57)(51-56)(51-58)(52-59)(53-59)(54-59)(55-59)
Measurements (5)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| A549 | 18 | — | 10.1016/j.jinorgbio.2019.01.01... | 2019 |
| HeLa | 27 | — | 10.1016/j.jinorgbio.2019.01.01... | 2019 |
| HepG2 | 27 | — | 10.1016/j.jinorgbio.2019.01.01... | 2019 |
| MCF-7 | 35 | — | 10.1016/j.jinorgbio.2019.01.01... | 2019 |
| BEAS-2B | 62 | — | 10.1016/j.jinorgbio.2019.01.01... | 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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