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D-MPNN
Complex #4288 — Ru(2)
[2]
2D Structure
⬇ MOL V3000
Info
ID
4288
Metal
Ru
Oxidation state
2
Charge
0
Donor atoms
{"N": 2}
Abbreviation
2
SMILES
Cc1ccc(C(C)C)cc1.Cc1ccc(S(=O)(=O)[N-]CCN(C)C)cc1.[Cl-]
TUCAN
C21H31N2O2RuS/(1-36)(2-35)(3-51)(4-51)(5-37)(6-33)(7-33)(8-32)(9-32)(10-33)(11-32)(12-40)(13-35)(14-48)(15-43)(16-42)(17-48)(18-48)(19-49)(20-49)(21-49)(22-50)(23-50)(24-35)(25-47)(26-34)(27-38)(28-39)(29-34)(30-34)(31-41)(32-44)(33-47)(34-47)(35-46)(36-40)(36-46)(37-39)(37-44)(38-41)(38-44)(39-45)(40-52)(41-45)(42-43)(42-52)(43-46)(45-47)(48-53)(49-53)(50-51)(50-53)(51-54)(52-57)(54-57)(54-58)(55-57)(56-57)(57-58)
Measurements (1)
Cell line
IC₅₀ dark (µM)
IC₅₀ light (µM)
DOI
Year
A2780
13
—
10.1039/c8dt00438b
2018