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D-MPNN
Complex #4444 — Ru(2)
[9]
2D Structure
⬇ MOL V3000
Info
ID
4444
Metal
Ru
Oxidation state
2
Charge
0
Donor atoms
{"N": 3}
Abbreviation
9
SMILES
COC(=O)Nc1nc2cc(Sc3ccccc3)ccc2[nH]1.Cc1ccc(C(C)C)cc1.[Cl-].[Cl-]
TUCAN
C25H27N3O2RuS/(1-31)(2-35)(3-45)(4-28)(5-28)(6-36)(7-28)(8-30)(9-29)(10-37)(11-29)(12-32)(13-34)(14-33)(15-30)(16-29)(17-49)(18-49)(19-42)(20-40)(21-38)(22-30)(23-39)(24-41)(25-49)(26-54)(27-53)(28-45)(29-45)(30-44)(31-36)(31-43)(32-33)(32-46)(33-52)(34-38)(34-51)(35-37)(35-43)(36-44)(37-44)(38-41)(39-41)(39-42)(40-47)(40-52)(42-51)(43-45)(46-47)(46-53)(47-55)(48-53)(48-54)(48-55)(49-57)(50-54)(50-56)(50-57)(51-58)(52-58)(55-59)(57-59)(58-59)
Measurements (1)
Cell line
IC₅₀ dark (µM)
IC₅₀ light (µM)
DOI
Year
HeLa
0.2
—
10.1002/chem.201303341
2013