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Complex #168 — Ru(2) [Complex 2]

2D Structure

Structure
⬇ MOL V3000

Info

ID168
MetalRu
Oxidation state2
Charge1
Donor atoms{"N": 2}
AbbreviationComplex 2
SMILESCc1ccc(C(C)C)cc1.[Cl-].c1ccc2nc(-c3nc4ccccc4o3)ccc2c1

TUCAN

C26H24N2ORu/(1-32)(2-35)(3-26)(4-34)(5-45)(6-41)(7-31)(8-38)(9-29)(10-39)(11-37)(12-33)(13-40)(14-30)(15-28)(16-25)(17-26)(18-26)(19-25)(20-25)(21-36)(22-27)(23-27)(24-27)(25-43)(26-45)(27-45)(28-30)(28-32)(29-33)(29-40)(30-42)(31-32)(31-47)(33-46)(34-35)(34-43)(35-44)(36-41)(36-44)(37-38)(37-42)(38-48)(39-40)(39-49)(41-43)(42-47)(44-45)(46-49)(46-51)(47-52)(48-50)(48-52)(49-53)(50-51)(50-53)(51-54)(52-54)

Measurements (4)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
HeLa10 10.1039/d0dt03107k 2020
Caco-212 10.1039/d0dt03107k 2020
MCF-718 10.1039/c9nj03663f 2020
HEK2932.6e+02 10.1039/d0dt03107k 2020

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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