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Complex #15 — Ru(2) [1]

2D Structure

Structure
⬇ MOL V3000

Info

ID15
MetalRu
Oxidation state2
Charge0
Donor atoms{"P": 1}
Abbreviation1
SMILESCc1ccc(C(C)C)cc1.[Cl-].[Cl-].c1ccc(SCP(c2ccccc2)c2ccccc2)cc1

TUCAN

C29Cl2PRuS/(1-23)(2-25)(3-25)(4-6)(4-7)(5-9)(5-12)(6-10)(7-28)(8-9)(8-13)(10-11)(11-28)(12-26)(13-26)(14-15)(14-27)(15-17)(16-17)(16-20)(18-21)(18-24)(19-22)(19-24)(20-27)(21-23)(22-23)(24-25)(26-30)(27-30)(28-31)(29-30)(29-31)

Measurements (5)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
A2531.7 10.1016/j.jinorgbio.2012.04.00... 2012
518A21.8 10.1016/j.jinorgbio.2012.04.00... 2012
8505C2.9 10.1016/j.jinorgbio.2012.04.00... 2012
SW4803.5 10.1016/j.jinorgbio.2012.04.00... 2012
MCF-76.6 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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