Info
| ID | 1321 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 1 |
| Donor atoms | {"N": 2, "P": 2} |
| Abbreviation | 2mG |
| SMILES | COC(=O)CNC(=O)c1cccc(P(c2ccccc2)c2ccccc2)c1.COC(=O)CNC(=O)c1cccc(P(c2ccccc2)c2ccccc2)c1.Cc1ccc(C(C)C)cc1.[Cl-] |
TUCAN
C54H54N2O6P2Ru/(1-55)(2-55)(3-94)(4-55)(5-60)(6-97)(7-62)(8-68)(9-70)(10-57)(11-63)(12-61)(13-57)(14-66)(15-76)(16-64)(17-75)(18-65)(19-97)(20-59)(21-77)(22-72)(23-79)(24-81)(25-80)(26-56)(27-56)(28-58)(29-56)(30-69)(31-97)(32-67)(33-57)(34-74)(35-83)(36-95)(37-95)(38-82)(39-84)(40-71)(41-73)(42-98)(43-78)(44-96)(45-96)(46-98)(47-85)(48-86)(49-98)(50-89)(51-87)(52-88)(53-109)(54-110)(55-94)(56-94)(57-90)(58-68)(58-91)(59-62)(59-63)(60-62)(60-103)(61-63)(61-103)(64-65)(64-105)(65-67)(66-76)(66-104)(67-69)(68-90)(69-75)(70-74)(70-90)(71-73)(71-78)(72-79)(72-106)(73-77)(74-91)(75-105)(76-81)(77-107)(78-80)(79-83)(80-107)(81-92)(82-85)(82-108)(83-93)(84-92)(84-104)(85-89)(86-88)(86-89)(87-93)(87-106)(88-108)(91-94)(92-99)(93-100)(95-101)(95-109)(96-102)(96-110)(97-115)(98-116)(99-109)(99-112)(100-110)(100-113)(101-111)(101-115)(102-114)(102-116)(103-117)(104-117)(105-117)(106-118)(107-118)(108-118)(115-119)(116-119)(117-119)(118-119)
Measurements (4)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| MDA-MB-231 | 12 | — | 10.1016/j.bioorg.2019.03.048 | 2019 |
| HEp-2 | 14 | — | 10.1016/j.bioorg.2019.03.048 | 2019 |
| NCI-H460 | 15 | — | 10.1016/j.bioorg.2019.03.048 | 2019 |
| HeLa | 16 | — | 10.1016/j.bioorg.2019.03.048 | 2019 |
🧬 Cell Death Types (1)
Autophagy
high
«Further investigation determined autophagy as the mode of cell death.»
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.
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