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Complex #3513 — Ru(2) [C1]

2D Structure

Structure
⬇ MOL V3000

Info

ID3513
MetalRu
Oxidation state2
Charge0
Donor atoms{"N": 2}
AbbreviationC1
SMILESCc1ccc(C(C)C)cc1.O=C(NC(=S)Nc1ccccc1)c1ccco1.[Cl-].[Cl-]

TUCAN

C22Cl2N2O2RuS/(1-16)(2-15)(3-16)(4-9)(4-17)(5-14)(5-20)(6-7)(6-12)(7-8)(8-18)(9-15)(10-11)(10-17)(11-15)(12-13)(13-18)(14-19)(16-17)(18-23)(19-26)(20-21)(20-26)(21-24)(21-25)(22-23)(22-24)(22-27)

Measurements (6)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
IMR-3215— 10.1002/chem.202004954 2021
HeLa23— 10.1002/chem.202004954 2021
HepG226— 10.1002/chem.202004954 2021
A43128— 10.1002/chem.202004954 2021
SW4031— 10.1002/chem.202004954 2021
Vero1.1e+02— 10.1002/chem.202004954 2021

🧬 Cell Death Types (1)

Apoptosis high
«They also promoted cell death by apoptosis and cell cycle arrest.»

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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