Info
| ID | 2629 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 1 |
| Donor atoms | {"O": 1, "N": 3, "P": 2} |
| Abbreviation | 4 |
| SMILES | O=C([O-])c1ccccc1Nc1cccc(C(F)(F)F)c1.c1ccc(-c2ccccn2)nc1.c1ccc(P(CCCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1 |
TUCAN
C51H43F3N3O2P2Ru/(1-44)(2-89)(3-45)(4-46)(5-81)(6-82)(7-78)(8-47)(9-89)(10-48)(11-52)(12-53)(13-55)(14-54)(15-51)(16-70)(17-50)(18-74)(19-90)(20-78)(21-61)(22-56)(23-62)(24-90)(25-49)(26-58)(27-60)(28-57)(29-63)(30-68)(31-64)(32-65)(33-66)(34-71)(35-67)(36-75)(37-69)(38-77)(39-72)(40-59)(41-76)(42-73)(43-95)(44-45)(44-46)(45-91)(46-48)(47-55)(47-56)(48-52)(49-50)(49-79)(50-51)(51-58)(52-91)(53-55)(53-92)(54-57)(54-63)(56-61)(57-62)(58-83)(59-80)(59-85)(60-70)(60-81)(61-92)(62-93)(63-65)(64-66)(64-68)(65-93)(66-94)(67-68)(67-69)(69-94)(70-71)(71-84)(72-77)(72-82)(73-74)(73-76)(74-85)(75-77)(75-86)(76-80)(78-89)(78-90)(79-83)(79-87)(80-88)(81-96)(82-97)(83-95)(84-86)(84-96)(85-95)(86-97)(87-98)(87-99)(88-100)(88-101)(88-102)(89-103)(90-104)(91-103)(92-103)(93-104)(94-104)(96-105)(97-105)(103-105)(104-105)
Measurements (5)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| A2780 | 2.1 | — | 10.1021/acs.inorgchem.4c04344 | 2025 |
| MDA-MB-231 | 2.3 | — | 10.1021/acs.inorgchem.4c04344 | 2025 |
| A2780cisR | 4.2 | — | 10.1021/acs.inorgchem.4c04344 | 2025 |
| MRC-5 | 4.4 | — | 10.1021/acs.inorgchem.4c04344 | 2025 |
| A549 | 6.9 | — | 10.1021/acs.inorgchem.4c04344 | 2025 |
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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