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D-MPNN
Complex #1307 — Ru(3)
[2]
2D Structure
⬇ MOL V3000
Info
ID
1307
Metal
Ru
Oxidation state
3
Charge
0
Donor atoms
{"N": 3}
Abbreviation
2
SMILES
COc1ccc2c(CN(Cc3ccccn3)Cc3ccccn3)cc(=O)oc2c1.[Cl-].[Cl-].[Cl-]
TUCAN
C23H21N3O3Ru/(1-24)(2-22)(3-37)(4-31)(5-41)(6-36)(7-26)(8-37)(9-25)(10-36)(11-27)(12-38)(13-30)(14-29)(15-28)(16-41)(17-38)(18-34)(19-23)(20-35)(21-41)(22-42)(22-43)(23-32)(23-44)(24-25)(24-34)(25-26)(26-39)(27-28)(27-35)(28-30)(29-31)(29-33)(30-40)(31-43)(32-33)(32-36)(33-42)(34-46)(35-47)(36-45)(37-39)(37-45)(38-40)(38-45)(39-46)(40-47)(41-50)(42-49)(43-50)(44-48)(44-49)(46-51)(47-51)(50-51)
Measurements (1)
Cell line
IC₅₀ dark (µM)
IC₅₀ light (µM)
DOI
Year
HeLa
1.4e+02
—
10.1016/j.ica.2019.04.018
2019