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Complex #8897 — Au(1)

2D Structure

Structure
⬇ MOL V3000

Info

ID8897
MetalAu
Oxidation state1
Charge1
Donor atoms{"N": 2, "F": 2, "O": 5, "P": 1}
Abbreviation
SMILESCCn1[c-][n+](CC)c(-c2ccc(F)cc2)c1-c1ccc(F)cc1.[C-]#CCOC(=O)[C@@]1(C)CC[C@]2(C)CC[C@]3(C)C(=CC(=O)[C@@H]4[C@@]5(C)CC[C@H](OC(=O)CCCCCCC[P+](c6ccccc6)(c6ccccc6)c6ccccc6)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1

Measurements (3)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
Hepa1-62.9 10.1021/acs.jmedchem.3c01785 2024
HepG23.1 10.1021/acs.jmedchem.3c01785 2024
Hep3B3.7 10.1021/acs.jmedchem.3c01785 2024

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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