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Complex #3788 — Ru(2) [1]

2D Structure

Structure
⬇ MOL V3000

Info

ID3788
MetalRu
Oxidation state2
Charge0
Donor atoms{"N": 3}
Abbreviation1
SMILESCCN(CC)CCCC(C)Nc1ccnc2cc(Cl)ccc12.Cc1ccc(C(C)C)cc1.[Cl-].[Cl-]

TUCAN

C28Cl3N3Ru/(1-19)(2-18)(3-21)(4-19)(5-27)(6-23)(7-10)(7-17)(8-11)(8-20)(9-22)(9-25)(10-28)(11-18)(12-14)(12-24)(13-26)(13-28)(14-27)(15-16)(15-18)(16-20)(17-25)(17-26)(19-20)(21-31)(22-30)(23-31)(24-31)(25-29)(26-30)(27-29)(28-34)

Measurements (4)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
LS1418— 10.1021/ic802220w 2009
HCT-116 p53+/+20— 10.1021/ic802220w 2009
HCT-116 p53-/-20— 10.1021/ic802220w 2009
HeLa29— 10.1002/chem.201303341 2013

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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