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D-MPNN
Complex #5492 — Ir(3)
[5]
2D Structure
⬇ MOL V3000
Info
ID
5492
Metal
Ir
Oxidation state
3
Charge
0
Donor atoms
{"N": 1}
Abbreviation
5
SMILES
Cc1c(C)c(C)[c-](-c2ccc(-c3ccccc3)cc2)c1C.[Cl-].[c-]1ccccc1-c1ccccn1
TUCAN
C32ClIrN/(1-22)(2-28)(3-27)(4-30)(5-6)(5-7)(6-8)(7-13)(8-23)(9-11)(9-12)(10-12)(10-16)(11-24)(13-23)(14-15)(14-26)(15-29)(16-24)(17-20)(17-21)(18-19)(18-26)(19-29)(20-32)(21-31)(22-27)(22-28)(23-32)(24-26)(25-28)(25-29)(25-30)(27-30)(31-33)(32-33)
Measurements (1)
Cell line
IC₅₀ dark (µM)
IC₅₀ light (µM)
DOI
Year
A2780
0.7
—
10.1021/om2005468
2011