Info
| ID | 143 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 2 |
| Donor atoms | {"N": 8} |
| Abbreviation | 3 |
| SMILES | CC1=CC(C)=[N+]2C1=C(c1ccc(-c3cc(-c4ccccn4)nc(-c4ccccn4)c3)cc1)c1c(C)cc(C)n1[B-]2(F)F.NCCCOc1ccc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)cc1 |
TUCAN
C58H50BF2N9ORu/(1-67)(2-68)(3-91)(4-61)(5-79)(6-108)(7-95)(8-80)(9-52)(10-76)(11-74)(12-82)(13-52)(14-92)(15-53)(16-72)(17-94)(18-62)(19-81)(20-64)(21-73)(22-70)(23-56)(24-58)(25-53)(26-71)(27-77)(28-75)(29-60)(30-53)(31-108)(32-95)(33-66)(34-52)(35-59)(36-93)(37-82)(38-65)(39-69)(40-57)(41-54)(42-63)(43-55)(44-78)(45-54)(46-55)(47-55)(48-54)(49-110)(50-110)(51-113)(51-114)(51-120)(51-121)(52-99)(53-85)(54-90)(55-107)(56-58)(56-109)(57-72)(57-73)(58-88)(59-74)(59-76)(60-77)(60-88)(61-62)(61-86)(62-83)(63-70)(63-86)(64-67)(64-68)(65-80)(65-106)(66-80)(66-94)(67-105)(68-92)(69-85)(69-99)(70-83)(71-89)(71-104)(72-97)(73-91)(74-93)(75-89)(75-96)(76-98)(77-109)(78-90)(78-107)(79-84)(79-101)(81-84)(81-100)(82-95)(82-108)(83-84)(85-102)(86-87)(87-102)(87-103)(88-89)(90-103)(91-116)(92-118)(93-111)(94-112)(95-110)(96-98)(96-115)(97-104)(97-116)(98-111)(99-113)(100-105)(100-117)(101-106)(101-117)(102-113)(103-114)(104-115)(105-118)(106-112)(107-114)(108-119)(109-119)(115-122)(116-122)(117-122)(118-122)(119-122)
Measurements (3)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| A549 | — | 0.5 | 10.1021/acs.inorgchem.1c01850 | 2021 |
| HeLa | — | 0.23 | 10.1021/acs.inorgchem.1c01850 | 2021 |
| HPL1D | — | 1.6 | 10.1021/acs.inorgchem.1c01850 | 2021 |
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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