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Complex #6449 — Os(2) [4b]

2D Structure

Structure
⬇ MOL V3000

Info

ID6449
MetalOs
Oxidation state2
Charge1
Donor atoms{"N": 3}
Abbreviation4b
SMILESCC(C)[C@H](N)c1nc2cc(Cl)ccc2c(=O)n1Cc1ccccc1.Cc1ccc(C(C)C)cc1.[Cl-]

TUCAN

C29Cl2N3OOs/(1-23)(2-19)(3-20)(4-20)(5-23)(6-7)(6-10)(7-22)(8-9)(8-18)(9-19)(10-12)(11-17)(11-19)(12-13)(13-22)(14-15)(14-21)(15-29)(16-26)(16-29)(17-18)(18-20)(21-26)(21-28)(22-24)(23-25)(24-32)(25-27)(25-30)(26-31)(27-31)(27-32)(28-32)(28-33)(29-35)

Measurements (6)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
SW6200.67— 10.1021/acs.inorgchem.0c00957 2020
HCT-1162.3— 10.1021/acs.inorgchem.0c00957 2020
NCI-H4605.4— 10.1021/acs.inorgchem.0c00957 2020
SW4807.5— 10.1021/acs.inorgchem.0c00957 2020
SiHa11— 10.1021/acs.inorgchem.0c00957 2020
HepG245— 10.1021/acs.inorgchem.0c00957 2020

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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