Info
| ID | 3837 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 1 |
| Donor atoms | {"N": 5} |
| Abbreviation | 4a |
| SMILES | Cc1ccc(C(C)C)cc1.Clc1ccc2[nH]/c(=N/N=C\c3ccccn3)c3c4ccccc4[nH]c3c2c1.[Cl-] |
TUCAN
C31H28ClN5Ru/(1-37)(2-51)(3-44)(4-38)(5-29)(6-35)(7-53)(8-33)(9-42)(10-34)(11-32)(12-43)(13-45)(14-41)(15-52)(16-40)(17-36)(18-30)(19-30)(20-30)(21-29)(22-31)(23-31)(24-29)(25-31)(26-39)(27-62)(28-61)(29-46)(30-51)(31-51)(32-42)(32-55)(33-36)(33-56)(34-36)(34-53)(35-49)(35-59)(37-38)(37-46)(38-47)(39-44)(39-47)(40-41)(40-42)(41-50)(43-45)(43-54)(44-46)(45-59)(47-51)(48-50)(48-57)(48-58)(49-54)(49-57)(50-55)(52-56)(52-64)(53-60)(54-61)(55-62)(56-60)(57-62)(58-61)(58-63)(59-65)(63-64)(63-66)(64-66)
Measurements (3)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| CH-1 | 0.32 | — | 10.1021/om101004z | 2010 |
| SW480 | 0.76 | — | 10.1021/om101004z | 2010 |
| A549 | 5.1 | — | 10.1021/om101004z | 2010 |
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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