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D-MPNN
Complex #3290 — Ru(2)
[42]
2D Structure
⬇ MOL V3000
Info
ID
3290
Metal
Ru
Oxidation state
2
Charge
1
Donor atoms
{"N": 2}
Abbreviation
42
SMILES
OCc1ccnc(-c2cc(CO)ccn2)c1.[Cl-].c1ccc2c(c1)CCC2
TUCAN
C21H22N2O2Ru/(1-31)(2-31)(3-25)(4-23)(5-32)(6-26)(7-27)(8-33)(9-33)(10-38)(11-24)(12-32)(13-30)(14-28)(15-42)(16-42)(17-39)(18-43)(19-43)(20-29)(21-46)(22-47)(23-24)(23-26)(24-27)(25-36)(25-40)(26-34)(27-35)(28-36)(28-38)(29-37)(29-39)(30-37)(30-41)(31-32)(31-34)(32-33)(33-35)(34-35)(36-42)(37-43)(38-44)(39-45)(40-41)(40-44)(41-45)(42-46)(43-47)(44-48)(45-48)
Measurements (1)
Cell line
IC₅₀ dark (µM)
IC₅₀ light (µM)
DOI
Year
A2780
—
—
10.1021/jm060596m
2006