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D-MPNN
Complex #4026 — Ru(2)
[3b]
2D Structure
⬇ MOL V3000
Info
ID
4026
Metal
Ru
Oxidation state
2
Charge
0
Donor atoms
{"N": 2}
Abbreviation
3b
SMILES
Cc1ccc(C(C)C)cc1.O=C1/C(=C/c2ccncc2)CCC/C1=C\c1ccncc1.[Cl-].[Cl-]
TUCAN
C28H30N2ORu/(1-34)(2-40)(3-46)(4-31)(5-31)(6-31)(7-41)(8-42)(9-44)(10-54)(11-39)(12-55)(13-44)(14-43)(15-45)(16-56)(17-45)(18-57)(19-46)(20-36)(21-32)(22-32)(23-35)(24-32)(25-33)(26-37)(27-33)(28-38)(29-33)(30-53)(31-47)(32-53)(33-53)(34-50)(34-54)(35-36)(35-47)(36-48)(37-38)(37-48)(38-47)(39-49)(39-50)(40-50)(40-55)(41-51)(41-56)(42-51)(42-57)(43-51)(43-52)(44-46)(44-49)(45-46)(45-52)(48-53)(49-58)(52-58)(54-59)(55-59)(56-60)(57-60)(58-61)(59-62)(60-62)
Measurements (1)
Cell line
IC₅₀ dark (µM)
IC₅₀ light (µM)
DOI
Year
MOLT-4
4
—
10.1016/j.poly.2019.07.034
2019