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D-MPNN
Complex #1266 — Ru(2)
[1]
2D Structure
⬇ MOL V3000
Info
ID
1266
Metal
Ru
Oxidation state
2
Charge
0
Donor atoms
{"N": 2}
Abbreviation
1
SMILES
Cc1ccc(C(C)C)cc1.Fc1ccc(/C(=C2\C=CC=N2)c2ccc[n-]2)cc1.[Cl-]
TUCAN
C25H24FN2Ru/(1-32)(2-25)(3-34)(4-26)(5-33)(6-29)(7-28)(8-30)(9-31)(10-39)(11-37)(12-45)(13-38)(14-46)(15-26)(16-25)(17-26)(18-27)(19-36)(20-27)(21-44)(22-35)(23-25)(24-27)(25-41)(26-44)(27-44)(28-31)(28-45)(29-32)(29-49)(30-37)(30-49)(31-47)(32-40)(33-34)(33-41)(34-42)(35-36)(35-42)(36-41)(37-40)(38-39)(38-48)(39-46)(40-43)(42-44)(43-47)(43-48)(45-50)(46-51)(47-50)(48-51)(49-52)(50-53)(51-53)
Measurements (1)
Cell line
IC₅₀ dark (µM)
IC₅₀ light (µM)
DOI
Year
A549
—
—
10.1016/j.ica.2016.03.003
2016