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D-MPNN
Complex #240 — Ru(3)
[NAMI-A]
2D Structure
⬇ MOL V3000
Info
ID
240
Metal
Ru
Oxidation state
3
Charge
-1
Donor atoms
{"S": 1, "O": 1, "N": 2}
Abbreviation
NAMI-A
SMILES
CS(C)=O.[Cl-].[Cl-].[Cl-].[Cl-].c1c[nH]cn1
TUCAN
C5H10N2ORuS/(1-13)(2-14)(3-14)(4-14)(5-15)(6-15)(7-12)(8-11)(9-15)(10-16)(11-12)(11-16)(12-17)(13-16)(13-17)(14-19)(15-19)(17-20)(18-19)(19-20)
Measurements (31)
Cell line
IC₅₀ dark (µM)
IC₅₀ light (µM)
DOI
Year
HeLa
46
—
10.1021/acs.organomet.3c00394
2024
HeLa
46
—
10.1002/aoc.6750
2022
MDA-MB-231
59
—
10.1021/acs.organomet.3c00394
2024
MDA-MB-231
59
—
10.1002/aoc.6750
2022
MCF-7
69
—
10.1002/aoc.6750
2022
A549
74
—
10.1002/aoc.6750
2022
A549
74
—
10.1021/acs.organomet.3c00394
2024
L-929
1.9e+02
—
10.1007/s00775-019-01743-5
2019
MCF-7
2.9e+02
—
10.1007/s00775-019-01743-5
2019
A549
3e+02
—
10.1007/s00775-013-1027-z
2013
HeLa
3.7e+02
—
10.1007/s00775-019-01743-5
2019
2008
5.1e+02
—
10.1007/s00280-004-0773-6
2004
HT-29
5.1e+02
—
10.1002/cmdc.200800039
2008
MCF-7
5.9e+02
—
10.1002/cmdc.200800039
2008
A2780
6e+02
—
10.1021/ma402078d
2014
HeLa
6e+02
—
10.1039/d0dt03974h
2021
AsPC-1
6e+02
—
10.1021/ma402078d
2014
OVCAR-3
7.4e+02
—
10.1021/ma402078d
2014
MCF-7
8e+02
—
10.1007/s00280-004-0773-6
2004
T47D
9e+02
—
10.1007/s00280-004-0773-6
2004
IGROV-1
2e+03
—
10.1007/s00280-004-0773-6
2004
MCF-7
—
—
10.1039/d0dt03974h
2021
L-929
—
—
10.1039/d0dt03974h
2021
MCF-10A
—
—
10.1002/aoc.6750
2022
S180
—
—
10.1039/d3nr02707d
2023
LLC
—
—
10.1039/d3nr02707d
2023
A549
—
—
10.1039/d3nr02707d
2023
LO2
—
—
10.1039/d3nr02707d
2023
A2780
—
—
10.1039/c0mt00101e
2011
A2780cisR
—
—
10.1039/c0mt00101e
2011
MCF-10A
—
—
10.1021/acs.organomet.3c00394
2024