Info
| ID | 1406 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 0 |
| Donor atoms | {"N": 2, "O": 1} |
| Abbreviation | 2a |
| SMILES | CCOC(=O)[C@H](Cc1ccccc1)NC(C)=O.[Cl-].[O-]c1c(Cl)cc(Cl)c2cccnc12 |
TUCAN
C22H21Cl2N2O4Ru/(1-38)(2-29)(3-28)(4-23)(5-23)(6-25)(7-26)(8-32)(9-32)(10-27)(11-37)(12-22)(13-22)(14-22)(15-38)(16-35)(17-24)(18-23)(19-30)(20-31)(21-44)(22-38)(23-40)(24-29)(24-35)(25-27)(25-30)(26-27)(26-33)(28-42)(28-43)(29-34)(30-31)(31-33)(32-33)(32-37)(34-36)(34-43)(35-45)(36-39)(36-45)(37-41)(37-44)(38-49)(39-42)(39-47)(40-44)(40-48)(41-46)(41-49)(42-50)(43-51)(45-52)(49-52)
Measurements (4)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| NCI-H460 | 4.2 | — | 10.1039/c7dt04451h | 2018 |
| HCT-116 | 4.7 | — | 10.1039/c7dt04451h | 2018 |
| SW480 | 9 | — | 10.1039/c7dt04451h | 2018 |
| SiHa | 14 | — | 10.1039/c7dt04451h | 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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