home← all complexes Ir builderC^N familiesD-MPNN

Complex #450 — Ru(2) [4]

2D Structure

Structure
⬇ MOL V3000

Info

ID450
MetalRu
Oxidation state2
Charge1
Donor atoms{"N": 4, "P": 1, "O": 1}
Abbreviation4
SMILESC1N2CN3CN1CP(C2)C3.Cc1ccc(C(C)C)cc1.[O-]n1ccc2ccccc2c1=S

TUCAN

C25N4OPRuS/(1-17)(2-17)(3-15)(4-6)(4-15)(5-7)(5-11)(6-16)(7-13)(8-9)(8-16)(9-15)(10-11)(10-14)(12-13)(12-18)(13-14)(14-25)(16-17)(18-29)(19-26)(19-27)(20-26)(20-28)(21-27)(21-28)(22-26)(22-31)(23-27)(23-31)(24-28)(24-31)(25-29)(25-32)(29-30)

Measurements (11)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
MRC-581 10.3390/ph14060518 2021
COLO-205 10.3390/ph14060518 2021
COLO-320 10.3390/ph14060518 2021
A2780 10.3390/cancers13102493 2021
A549 10.3390/cancers13102493 2021
HCT-116 10.3390/cancers13102493 2021
OE19 10.3390/cancers13102493 2021
HepG2 10.3390/cancers13102493 2021
PC-3 10.3390/cancers13102493 2021
SK-OV-3 10.3390/cancers13102493 2021
SW626 10.3390/cancers13102493 2021

🧬 Cell Death Types (1)

Apoptosis high
«Complex 5 was also reported to be cytotoxic against a series of human cancer cells and induced caspase-dependent cell death in leukemia cells [17].»

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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