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D-MPNN
Complex #5300 — Ir(3)
[Ir1]
2D Structure
⬇ MOL V3000
Info
ID
5300
Metal
Ir
Oxidation state
3
Charge
1
Donor atoms
{"N": 2}
Abbreviation
Ir1
SMILES
Cc1c(C)c(C)[c-](C)c1C.Cc1ccnc(-c2cc(C(=O)O)ccn2)c1.[Cl-]
TUCAN
C22H25IrN2O2/(1-26)(2-26)(3-26)(4-27)(5-27)(6-27)(7-28)(8-28)(9-30)(10-33)(11-43)(12-30)(13-35)(14-44)(15-32)(16-30)(17-34)(18-28)(19-29)(20-29)(21-29)(22-31)(23-31)(24-31)(25-51)(26-37)(27-38)(28-39)(29-41)(30-36)(31-42)(32-36)(32-45)(33-36)(33-43)(34-40)(34-44)(35-40)(35-46)(37-38)(37-39)(38-41)(39-42)(40-47)(41-42)(43-49)(44-48)(45-46)(45-49)(46-48)(47-50)(47-51)(48-52)(49-52)
Measurements (1)
Cell line
IC₅₀ dark (µM)
IC₅₀ light (µM)
DOI
Year
A2780
—
—
10.1016/j.ica.2019.119396
2020