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Complex #4221 — Ru(2) [1b]

2D Structure

Structure
⬇ MOL V3000

Info

ID4221
MetalRu
Oxidation state2
Charge0
Donor atoms{"O": 1, "N": 1}
Abbreviation1b
SMILESCc1ccc(C(C)C)cc1.[Cl-].[O-]n1c(=S)ccc2ccccc21

TUCAN

C19ClNORuS/(1-14)(2-15)(3-14)(4-7)(4-18)(5-6)(5-7)(6-17)(8-10)(8-15)(9-13)(9-19)(10-16)(11-12)(11-15)(12-16)(13-17)(14-16)(17-18)(18-20)(19-20)(19-22)(20-21)

Measurements (10)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
A27802.2— 10.3390/cancers13102493 2021
A2780cisR2.5— 10.3390/cancers13102493 2021
SW6262.8— 10.3390/cancers13102493 2021
A2780/ADR2.8— 10.3390/cancers13102493 2021
PC-33.9— 10.3390/cancers13102493 2021
SK-OV-35.1— 10.3390/cancers13102493 2021
A5495.8— 10.3390/cancers13102493 2021
HCT-1168.4— 10.3390/cancers13102493 2021
OE1911— 10.3390/cancers13102493 2021
HepG226— 10.3390/cancers13102493 2021

🧬 Cell Death Types (1)

Apoptosis medium
«A2780 cells treated with complex 1a only showed partial evidence for apoptotic cell death (8.4% of cell population)»

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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