Info
| ID | 386 |
| Metal | Ru |
| Oxidation state | 3 |
| Charge | 0 |
| Donor atoms | {"O": 1, "N": 4, "P": 2} |
| Abbreviation | 1 |
| SMILES | [Cl-].[Cl-].[O-]/C(=N\N=C/c1nc2ccccc2s1)c1ccccn1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1 |
TUCAN
C50H39N4OP2RuS/(1-45)(2-41)(3-47)(4-48)(5-40)(6-49)(7-51)(8-50)(9-52)(10-42)(11-43)(12-44)(13-74)(14-77)(15-75)(16-76)(17-53)(18-55)(19-46)(20-57)(21-58)(22-59)(23-62)(24-56)(25-54)(26-64)(27-67)(28-68)(29-65)(30-71)(31-66)(32-70)(33-72)(34-69)(35-60)(36-61)(37-63)(38-73)(39-78)(40-45)(40-82)(41-45)(41-47)(42-47)(42-82)(43-48)(43-83)(44-49)(44-83)(46-51)(46-84)(48-50)(49-50)(51-53)(52-53)(52-57)(54-55)(54-56)(55-58)(56-59)(57-84)(58-85)(59-85)(60-61)(60-78)(61-63)(62-64)(62-86)(63-80)(64-71)(65-67)(65-86)(66-68)(66-87)(67-71)(68-72)(69-70)(69-87)(70-72)(73-74)(73-88)(74-75)(75-76)(76-79)(77-89)(77-92)(78-91)(79-88)(79-90)(80-81)(80-91)(81-93)(81-94)(82-95)(83-95)(84-95)(85-96)(86-96)(87-96)(88-97)(89-90)(89-97)(92-93)(92-98)(93-98)(95-98)(96-98)(97-98)
Measurements (1)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| HCC70 | — | — | 10.1016/j.poly.2020.114569 | 2020 |
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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