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Complex #7800 — Au(1)

2D Structure

Structure
⬇ MOL V3000

Info

ID7800
MetalAu
Oxidation state1
Charge1
Donor atoms{"N": 2, "P": 1}
Abbreviation—
SMILESCCn1[c-][n+](CC)c2ccccc21.c1ccc(P(c2ccccc2)c2ccccc2)cc1

Measurements (14)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
Expc30.08— 10.1186/1476-4598-13-221 2014
MIA PaCa-20.08— 10.1186/1476-4598-13-221 2014
HT-290.4— 10.1021/jm201220n 2011
MCF-70.41— 10.1002/cmdc.201400056 2014
HEK2930.41— 10.1021/jm201220n 2011
ASPC10.7— 10.1186/1476-4598-13-221 2014
ASPC10.77— 10.1186/1476-4598-13-221 2014
PANC-10.82— 10.1186/1476-4598-13-221 2014
PANC-10.89— 10.1186/1476-4598-13-221 2014
HT-290.89— 10.1002/cmdc.201400056 2014
MCF-70.89— 10.1021/jm201220n 2011
ASPC11.2— 10.1186/1476-4598-13-221 2014
PANC-11.9— 10.1186/1476-4598-13-221 2014
HFF20— 10.1186/1476-4598-13-221 2014

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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