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D-MPNN
Complex #4607 — Ru(2)
[2]
2D Structure
⬇ MOL V3000
Info
ID
4607
Metal
Ru
Oxidation state
2
Charge
1
Donor atoms
{"S": 3, "O": 1, "N": 2}
Abbreviation
2
SMILES
C1CSCCSCCS1.O=C([O-])c1ccccn1.c1ccncc1
TUCAN
C17H21N2O2RuS3/(1-28)(2-27)(3-29)(4-30)(5-23)(6-33)(7-33)(8-34)(9-34)(10-35)(11-35)(12-36)(13-36)(14-37)(15-37)(16-38)(17-38)(18-26)(19-24)(20-22)(21-25)(22-23)(22-26)(23-28)(24-25)(24-27)(25-31)(26-30)(27-29)(28-39)(29-40)(30-39)(31-32)(31-40)(32-41)(32-42)(33-38)(33-43)(34-36)(34-43)(35-37)(35-44)(36-44)(37-45)(38-45)(39-46)(40-46)(43-46)(44-46)(45-46)
Measurements (1)
Cell line
IC₅₀ dark (µM)
IC₅₀ light (µM)
DOI
Year
MDA-MB-231
—
—
10.1002/ejic.201300792
2013