Info
| ID | 6369 |
| Metal | Re |
| Oxidation state | 1 |
| Charge | 1 |
| Donor atoms | {"O": 3, "N": 4} |
| Abbreviation | 1 |
| SMILES | [C-]#[O+].[C-]#[O+].[C-]#[O+].[Cl-].[NH3+]CCCCN(Cc1ccc2ccccc2n1)Cc1ccc2ccccc2n1 |
TUCAN
C27H27N4O3Re/(1-44)(2-30)(3-39)(4-29)(5-37)(6-31)(7-44)(8-47)(9-41)(10-41)(11-47)(12-33)(13-45)(14-38)(15-46)(16-40)(17-32)(18-28)(19-45)(20-34)(21-46)(22-40)(23-36)(24-35)(25-55)(26-55)(27-55)(28-31)(28-42)(29-30)(29-31)(30-48)(32-33)(32-42)(33-49)(34-38)(34-43)(35-36)(35-43)(36-50)(37-38)(37-39)(39-51)(40-41)(40-47)(41-46)(42-48)(43-51)(44-49)(44-56)(45-50)(45-56)(46-55)(47-56)(48-57)(49-57)(50-58)(51-58)(52-59)(53-60)(54-61)(57-62)(58-62)
Measurements (2)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| BeWo | 3.8e+02 | — | 10.1021/jm900777v | 2009 |
| CHO | 2.6e+03 | — | 10.1021/jm900777v | 2009 |
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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