Info
| ID | 1248 |
| Metal | Ru |
| Oxidation state | 3 |
| Charge | 0 |
| Donor atoms | {"N": 3} |
| Abbreviation | P1 |
| SMILES | Clc1ccc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)cc1.[Cl-].[Cl-].[Cl-] |
TUCAN
C21H14ClN3Ru/(1-20)(2-17)(3-25)(4-16)(5-24)(6-18)(7-30)(8-26)(9-19)(10-22)(11-15)(12-21)(13-23)(14-29)(15-18)(15-32)(16-20)(16-28)(17-18)(17-29)(19-27)(19-31)(20-35)(21-26)(21-30)(22-25)(22-28)(23-26)(23-34)(24-27)(24-33)(25-35)(27-28)(29-36)(30-38)(31-32)(31-37)(32-36)(33-34)(33-37)(34-38)(35-39)(37-40)(38-40)
Measurements (3)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| MRC-5 | 65 | — | 10.1016/j.jinorgbio.2016.10.00... | 2016 |
| HeLa | 83 | — | 10.1016/j.jinorgbio.2016.10.00... | 2016 |
| A549 | — | — | 10.1016/j.jinorgbio.2016.10.00... | 2016 |
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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