Info
| ID | 3927 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 1 |
| Donor atoms | {"N": 2, "S": 1, "P": 4} |
| Abbreviation | Ru5 |
| SMILES | O=c1[nH]c([S-])nc2ccccc12.c1ccc(P(CCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1.c1ccc(P(CCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1 |
TUCAN
C60H53N2OP4RuS/(1-55)(2-59)(3-60)(4-56)(5-61)(6-64)(7-63)(8-65)(9-66)(10-54)(11-68)(12-67)(13-62)(14-70)(15-101)(16-101)(17-72)(18-73)(19-71)(20-75)(21-78)(22-74)(23-77)(24-102)(25-102)(26-103)(27-103)(28-80)(29-76)(30-79)(31-104)(32-104)(33-84)(34-83)(35-81)(36-87)(37-85)(38-82)(39-88)(40-86)(41-89)(42-94)(43-90)(44-92)(45-91)(46-96)(47-95)(48-97)(49-69)(50-57)(51-58)(52-93)(53-114)(54-55)(54-56)(55-59)(56-60)(57-58)(57-93)(58-69)(59-105)(60-105)(61-62)(61-64)(62-63)(63-65)(64-106)(65-106)(66-67)(66-107)(67-77)(68-71)(68-107)(69-99)(70-74)(70-108)(71-77)(72-76)(72-108)(73-79)(73-109)(74-84)(75-83)(75-109)(76-84)(78-85)(78-110)(79-87)(80-86)(80-110)(81-89)(81-111)(82-90)(82-111)(83-87)(85-88)(86-88)(89-94)(90-94)(91-92)(91-112)(92-97)(93-98)(95-96)(95-97)(96-112)(98-99)(98-100)(99-115)(100-114)(100-116)(101-102)(101-117)(102-118)(103-104)(103-119)(104-120)(105-117)(106-117)(107-118)(108-118)(109-119)(110-119)(111-120)(112-120)(113-114)(113-115)(113-121)(115-122)(117-122)(118-122)(119-122)(120-122)
Measurements (6)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| A549 | 0.05 | — | 10.1021/acs.inorgchem.1c01539 | 2021 |
| MDA-MB-231 | 0.3 | — | 10.1021/acs.inorgchem.1c01539 | 2021 |
| MRC-5 | 5.7 | — | 10.1021/acs.inorgchem.1c01539 | 2021 |
| DU-145 | 6 | — | 10.1021/acs.inorgchem.1c01539 | 2021 |
| MCF-7 | 6.3 | — | 10.1021/acs.inorgchem.1c01539 | 2021 |
| HepG2 | 7.4 | — | 10.1021/acs.inorgchem.1c01539 | 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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