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D-MPNN
Complex #2196 — Ru(2)
[1]
2D Structure
⬇ MOL V3000
Info
ID
2196
Metal
Ru
Oxidation state
2
Charge
1
Donor atoms
{"N": 4, "O": 1, "P": 2}
Abbreviation
1
SMILES
Cc1c[nH]c(=O)nc1[O-].c1ccc(-c2ccccn2)nc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
TUCAN
C51H43N4O2P2Ru/(1-46)(2-49)(3-50)(4-54)(5-45)(6-51)(7-47)(8-52)(9-48)(10-53)(11-55)(12-44)(13-71)(14-44)(15-60)(16-57)(17-58)(18-61)(19-56)(20-64)(21-59)(22-62)(23-70)(24-63)(25-83)(26-69)(27-65)(28-66)(29-72)(30-73)(31-74)(32-76)(33-77)(34-75)(35-84)(36-67)(37-68)(38-78)(39-82)(40-44)(41-80)(42-79)(43-95)(44-81)(45-46)(45-49)(46-89)(47-49)(47-50)(48-51)(48-54)(50-89)(51-90)(52-55)(52-90)(53-57)(53-91)(54-55)(56-58)(56-91)(57-60)(58-60)(59-61)(59-64)(61-62)(62-65)(63-66)(63-70)(64-92)(65-92)(66-93)(67-68)(67-71)(68-85)(69-70)(69-72)(71-83)(72-93)(73-74)(73-94)(74-77)(75-76)(75-94)(76-77)(78-80)(78-86)(79-80)(79-84)(81-82)(81-87)(82-95)(83-96)(84-97)(85-86)(85-96)(86-97)(87-98)(87-99)(88-95)(88-98)(88-100)(89-101)(90-101)(91-101)(92-102)(93-102)(94-102)(96-103)(97-103)(98-103)(101-103)(102-103)
Measurements (40)
Cell line
IC₅₀ dark (µM)
IC₅₀ light (µM)
DOI
Year
B16-F10
0.01
—
10.1039/c7nj04368f
2018
HL60
0.01
—
10.1039/c7nj04368f
2018
K-562
0.1
—
10.1039/c7nj04368f
2018
SCC-4
0.21
—
10.1016/j.biopha.2025.118080
2025
HepG2
0.82
—
10.1016/j.biopha.2025.118080
2025
SCC-9
0.88
—
10.1016/j.biopha.2025.118080
2025
HSC-3
1.1
—
10.3390/ijms19061609
2018
CAL-27
1.1
—
10.1016/j.biopha.2025.118080
2025
PBMC
1.2
—
10.1039/c7nj04368f
2018
BJ
1.3
—
10.1016/j.biopha.2025.118080
2025
K-562
1.3
—
10.3390/ijms19061609
2018
HL60
1.4
—
10.3390/ijms19061609
2018
B16-F10
1.4
—
10.3390/ijms19061609
2018
Jurkat
1.5
—
10.1016/j.biopha.2025.118080
2025
HL60
1.5
—
10.1016/j.biopha.2025.118080
2025
K-562
1.5
—
10.1016/j.biopha.2025.118080
2025
PANC-1
1.5
—
10.1016/j.biopha.2025.118080
2025
HCT-116
1.6
—
10.3390/ijms19061609
2018
A375
1.7
—
10.1016/j.biopha.2025.118080
2025
PBMC
1.7
—
10.3390/ijms19061609
2018
SCC-25
1.7
—
10.1016/j.biopha.2025.118080
2025
NB4
1.8
—
10.1016/j.biopha.2025.118080
2025
HepG2
1.8
—
10.1039/c7nj04368f
2018
HSC-3
2
—
10.1016/j.biopha.2025.118080
2025
B16-F10
2.1
—
10.1016/j.biopha.2025.118080
2025
OVCAR-3
2.1
—
10.1016/j.biopha.2025.118080
2025
THP-1
2.4
—
10.1016/j.biopha.2025.118080
2025
SCC-9
2.4
—
10.3390/ijms19061609
2018
KG-1a
2.4
—
10.1016/j.biopha.2025.118080
2025
MDA-MB-231
2.5
—
10.1016/j.biopha.2025.118080
2025
DU-145
2.6
—
10.1016/j.biopha.2025.118080
2025
U-87 MG
2.6
—
10.1016/j.biopha.2025.118080
2025
MCF-7
2.7
—
10.1016/j.biopha.2025.118080
2025
HepG2
2.8
—
10.3390/ijms19061609
2018
A549
3.1
—
10.1016/j.biopha.2025.118080
2025
4T1
3.2
—
10.1016/j.biopha.2025.118080
2025
MRC-5
3.8
—
10.1016/j.biopha.2025.118080
2025
PBMC
5.3
—
10.1016/j.biopha.2025.118080
2025
MCF-7
11
—
10.3390/ijms19061609
2018
MRC-5
12
—
10.3390/ijms19061609
2018
🧬 Cell Death Types (1)
Apoptosis
high
«the [Ru(PPh3)2(Thy)(bipy)]PF6 complex displays potent cytotoxicity to different cancer cells and induces caspase-mediated apoptosis in HL-60 cells»