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Complex #4325 — Ru(2) [RuP1P]

2D Structure

Structure
⬇ MOL V3000

Info

ID4325
MetalRu
Oxidation state2
Charge1
Donor atoms{"N": 3}
AbbreviationRuP1P
SMILESCc1ccc(C(C)C)cc1.S=C(N/N=C/c1ccc2ccc3cccc4ccc1c2c34)N1CCCC1.[Cl-]

TUCAN

C32ClN3RuS/(1-21)(2-24)(3-24)(4-17)(4-20)(5-12)(5-19)(6-13)(6-20)(7-14)(7-19)(8-9)(8-29)(9-31)(10-18)(10-26)(11-15)(11-25)(12-21)(13-25)(14-21)(15-16)(16-26)(17-28)(18-27)(19-24)(20-23)(22-23)(22-25)(22-26)(23-27)(27-28)(28-30)(29-33)(30-35)(31-33)(32-33)(32-34)(32-36)(34-35)

Measurements (4)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
MDA-MB-23122— 10.1021/acs.organomet.3c00394 2024
MCF-10A57— 10.1021/acs.organomet.3c00394 2024
A54978— 10.1021/acs.organomet.3c00394 2024
HeLa91— 10.1021/acs.organomet.3c00394 2024

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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