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D-MPNN
Complex #1268 — Ru(2)
[3]
2D Structure
⬇ MOL V3000
Info
ID
1268
Metal
Ru
Oxidation state
2
Charge
0
Donor atoms
{"N": 2}
Abbreviation
3
SMILES
Cc1ccc(C(C)C)cc1.Fc1c(F)c(F)c(/C(=C2\C=CC=N2)c2ccc[n-]2)c(F)c1F.[Cl-]
TUCAN
C25H20F5N2Ru/(1-22)(2-25)(3-22)(4-24)(5-21)(6-21)(7-22)(8-21)(9-37)(10-28)(11-38)(12-29)(13-30)(14-31)(15-23)(16-26)(17-23)(18-36)(19-27)(20-23)(21-33)(22-36)(23-36)(24-25)(24-33)(25-34)(26-27)(26-34)(27-33)(28-29)(28-37)(29-39)(30-31)(30-38)(31-40)(32-35)(32-39)(32-40)(34-36)(35-44)(35-45)(37-46)(38-47)(39-46)(40-47)(41-42)(41-44)(41-51)(42-43)(42-48)(43-45)(43-52)(44-49)(45-50)(46-53)(47-53)
Measurements (1)
Cell line
IC₅₀ dark (µM)
IC₅₀ light (µM)
DOI
Year
A549
62
—
10.1016/j.ica.2016.03.003
2016