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Complex #1689 — Ru(2) [2 b]

2D Structure

Structure
⬇ MOL V3000

Info

ID1689
MetalRu
Oxidation state2
Charge1
Donor atoms{"N": 4, "P": 1, "O": 1}
Abbreviation2 b
SMILESC1N2CN3CN1CP(C2)C3.Cc1ccc(C(C)C)cc1.Cc1cccn([O-])c1=S

TUCAN

C22N4OPRuS/(1-11)(2-11)(3-14)(4-12)(5-6)(5-15)(6-12)(7-8)(7-13)(8-14)(9-10)(9-14)(10-13)(11-13)(12-22)(15-26)(16-23)(16-24)(17-23)(17-25)(18-24)(18-25)(19-23)(19-28)(20-24)(20-28)(21-25)(21-28)(22-26)(22-29)(26-27)

Measurements (8)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
A5492.2— 10.1002/chem.201903109 2019
HCT-1163.1— 10.1002/chem.201903109 2019
SK-OV-33.8— 10.1002/chem.201903109 2019
OE194— 10.1002/chem.201903109 2019
HepG27.9— 10.1002/chem.201903109 2019
MRC-59.1— 10.1002/chem.201903109 2019
SW6269.4— 10.1002/chem.201903109 2019
PC-310— 10.1002/chem.201903109 2019

🧬 Cell Death Types (1)

Apoptosis high
«Both compounds trigger early apoptosis»

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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