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Complex #2399 — Ru(2) [Ru-2]

2D Structure

Structure
⬇ MOL V3000

Info

ID2399
MetalRu
Oxidation state2
Charge2
Donor atoms{"N": 8}
AbbreviationRu-2
SMILESNC(=S)N/N=C1\C(=O)Nc2ccccc21.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1

TUCAN

C29H24N8ORuS/(1-42)(2-25)(3-29)(4-43)(5-30)(6-36)(7-40)(8-31)(9-39)(10-28)(11-26)(12-27)(13-32)(14-38)(15-34)(16-33)(17-44)(18-37)(19-35)(20-45)(21-54)(22-55)(23-54)(24-56)(25-28)(25-42)(26-28)(26-48)(27-32)(27-49)(29-32)(29-43)(30-33)(30-44)(31-38)(31-40)(33-34)(34-50)(35-37)(35-51)(36-37)(36-45)(38-46)(39-40)(39-41)(41-46)(41-47)(42-57)(43-58)(44-59)(45-60)(46-55)(47-52)(47-61)(48-49)(48-57)(49-58)(50-51)(50-59)(51-60)(52-55)(52-62)(53-54)(53-56)(53-63)(56-61)(57-64)(58-64)(59-64)(60-64)(61-64)

Measurements (3)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
Molt4/C827 10.1016/j.bmc.2007.08.014 2007
CEM48 10.1016/j.bmc.2007.08.014 2007
L12102.5e+02 10.1016/j.bmc.2007.08.014 2007

Source-assisted 2D generator

Builds the drawing from source ligand graphs and explicit donor metadata, then uses Metal2D only for layout. Publication output uses black bonds without arrows or colour highlighting; validated octahedral enantiomers are encoded directly with solid and hashed wedge bonds.

experimental validation surface
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