Info
| ID | 6427 |
| Metal | Os |
| Oxidation state | 2 |
| Charge | 1 |
| Donor atoms | {"N": 5} |
| Abbreviation | 13b |
| SMILES | COCc1cccc2nc(-c3n[nH]c4ncc(Br)cc34)[nH]c12.Cc1ccc(C(C)C)cc1.[Cl-] |
TUCAN
C25H26BrN5OOs/(1-30)(2-34)(3-42)(4-35)(5-28)(6-27)(7-31)(8-28)(9-27)(10-27)(11-28)(12-29)(13-29)(14-32)(15-29)(16-49)(17-49)(18-50)(19-49)(20-50)(21-43)(22-36)(23-37)(24-33)(25-53)(26-54)(27-42)(28-38)(29-42)(30-31)(30-40)(31-38)(32-34)(32-38)(33-39)(33-51)(34-40)(35-36)(35-45)(36-37)(37-41)(39-46)(39-48)(40-42)(41-44)(41-50)(43-51)(43-52)(44-45)(44-53)(45-55)(46-47)(46-56)(47-53)(47-55)(48-52)(48-54)(49-57)(50-57)(51-58)(54-56)(55-59)(56-59)(57-59)
Measurements (3)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| CH-1 | 7.9 | — | 10.1021/ic201704u | 2011 |
| SW480 | 12 | — | 10.1021/ic201704u | 2011 |
| A549 | 89 | — | 10.1021/ic201704u | 2011 |
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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