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Complex #19 — Ru(2) [5]

2D Structure

Structure
⬇ MOL V3000

Info

ID19
MetalRu
Oxidation state2
Charge0
Donor atoms{"P": 1}
Abbreviation5
SMILESCc1ccc(C(C)C)cc1.O=S(CCP(c1ccccc1)c1ccccc1)c1ccccc1.[Cl-].[Cl-]

TUCAN

C30Cl2OPRuS/(1-23)(2-24)(3-24)(4-5)(4-8)(5-27)(6-9)(6-18)(7-9)(7-22)(8-14)(10-14)(10-27)(11-15)(11-21)(12-17)(12-25)(13-20)(13-25)(15-16)(16-28)(17-23)(18-30)(19-21)(19-28)(20-23)(22-30)(24-25)(26-29)(26-32)(27-32)(28-32)(29-33)(30-33)(31-33)

Measurements (5)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
MCF-710 10.1016/j.jinorgbio.2012.04.00... 2012
518A219 10.1016/j.jinorgbio.2012.04.00... 2012
SW48020 10.1016/j.jinorgbio.2012.04.00... 2012
A25327 10.1016/j.jinorgbio.2012.04.00... 2012
8505C29 10.1016/j.jinorgbio.2012.04.00... 2012

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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