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Complex #8858 — Au(1)

2D Structure

Structure
⬇ MOL V3000

Info

ID8858
MetalAu
Oxidation state1
Charge0
Donor atoms{"P": 1, "N": 5, "S": 1}
Abbreviation
SMILESCCP(CC)CC.Nc1nc([S-])c2nc[nH]c2n1

Measurements (11)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
EA.hy9261.1 10.1007/s00775-022-01968-x 2022
MCF-7/Topo4.9 10.1007/s00775-022-01968-x 2022
HT-295.8 10.1007/s00775-022-01968-x 2022
U-87 MG7 10.1007/s00775-022-01968-x 2022
KB-V1(Vp)10 10.1007/s00775-022-01968-x 2022
HCT-116 p53-/-11 10.1007/s00775-022-01968-x 2022
KB-V1/Vbl12 10.1007/s00775-022-01968-x 2022
HeLa15 10.1007/s00775-022-01968-x 2022
518A216 10.1007/s00775-022-01968-x 2022
MCF-721 10.1007/s00775-022-01968-x 2022
HCT-11625 10.1007/s00775-022-01968-x 2022

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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