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Complex #8204 — Au(1)

2D Structure

Structure
⬇ MOL V3000

Info

ID8204
MetalAu
Oxidation state1
Charge0
Donor atoms{"O": 9, "N": 3, "F": 3, "Cl": 2}
Abbreviation
SMILESCC(=O)OC[C@H]1O[C@@H](n2[c-][n+](CCc3ncc(C(F)(F)F)cc3Cl)cc2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O.[Cl-]

Measurements (13)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
LXFL 5296.2 10.1002/hlca.201500529 2016
RXF 48613 10.1002/hlca.201500529 2016
PRXF 22714 10.1002/hlca.201500529 2016
GXF 25122 10.1002/hlca.201500529 2016
MAXF 40125 10.1002/hlca.201500529 2016
CXF HT-2933 10.1002/hlca.201500529 2016
UXF-113834 10.1002/hlca.201500529 2016
MEXF 46252 10.1002/hlca.201500529 2016
RL156 10.1002/hlca.201500529 2016
OVXF 89961 10.1002/hlca.201500529 2016
LXFA 62962 10.1002/hlca.201500529 2016
PAXF 16571e+02 10.1002/hlca.201500529 2016
PXF 17521e+02 10.1002/hlca.201500529 2016

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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