Info
| ID | 547 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 1 |
| Donor atoms | {"N": 7, "P": 1} |
| Abbreviation | 6 |
| SMILES | COc1ccc2cc(C(C)C(=O)OCc3ccncc3)ccc2c1.[Cl-].c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1cnn(C(n2cccn2)n2cccn2)c1 |
TUCAN
C48H44N7O3PRu/(1-58)(2-48)(3-50)(4-51)(5-46)(6-78)(7-80)(8-49)(9-81)(10-47)(11-55)(12-52)(13-70)(14-53)(15-64)(16-65)(17-87)(18-87)(19-59)(20-83)(21-57)(22-54)(23-61)(24-60)(25-69)(26-62)(27-86)(28-86)(29-86)(30-63)(31-56)(32-77)(33-85)(34-82)(35-66)(36-68)(37-67)(38-79)(39-84)(40-45)(41-71)(42-45)(43-76)(44-45)(45-76)(46-48)(46-90)(47-48)(47-50)(49-50)(49-90)(51-54)(51-55)(52-70)(52-73)(53-72)(53-79)(54-57)(55-91)(56-61)(56-67)(57-59)(58-78)(58-80)(59-91)(60-61)(60-92)(62-63)(62-74)(63-88)(64-74)(64-75)(65-73)(65-88)(66-77)(66-81)(67-69)(68-82)(68-83)(69-92)(70-75)(71-72)(71-84)(72-87)(73-74)(75-76)(76-89)(77-98)(78-94)(79-97)(80-93)(81-95)(82-99)(83-96)(84-97)(85-94)(85-95)(85-96)(86-101)(87-102)(88-101)(89-100)(89-102)(90-103)(91-103)(92-103)(93-94)(95-98)(96-99)(97-104)(98-104)(99-104)(101-104)(102-104)(103-104)
Measurements (3)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| HEK293T | 4.3 | — | 10.1039/d2dt03009h | 2022 |
| A2780 | 5 | — | 10.1039/d2dt03009h | 2022 |
| A2780cisR | 10 | — | 10.1039/d2dt03009h | 2022 |
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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