Info
| ID | 625 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 1 |
| Donor atoms | {"N": 3, "O": 1} |
| Abbreviation | I |
| SMILES | CNC(=S)N/N=C/c1ccc([N+](=O)[O-])s1.Cc1ccc(C(C)C)cc1.[Cl-] |
TUCAN
C17H22N4O2RuS2/(1-25)(2-23)(3-34)(4-26)(5-23)(6-23)(7-25)(8-28)(9-27)(10-24)(11-24)(12-24)(13-29)(14-35)(15-35)(16-36)(17-30)(18-31)(19-25)(20-35)(21-40)(22-41)(23-34)(24-34)(25-32)(26-28)(26-33)(27-29)(27-33)(28-32)(29-32)(30-31)(30-37)(31-38)(33-34)(35-40)(36-37)(36-43)(37-47)(38-42)(38-47)(39-40)(39-41)(39-46)(41-43)(42-44)(42-45)(43-48)(47-48)
Measurements (2)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| A2780 | 2.1 | — | 10.3389/fphar.2022.882756 | 2022 |
| OVCAR-3 | 5.5 | — | 10.3389/fphar.2022.882756 | 2022 |
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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