Info
| ID | 2146 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 1 |
| Donor atoms | {"N": 3} |
| Abbreviation | 2b |
| SMILES | Cc1ccc(C(C)C)cc1.O=Cc1c[c-]c(-n2cccn2)cc1.c1ccncc1 |
TUCAN
C25H26N3ORu/(1-46)(2-31)(3-27)(4-36)(5-28)(6-35)(7-27)(8-38)(9-32)(10-40)(11-39)(12-47)(13-48)(14-34)(15-27)(16-28)(17-28)(18-29)(19-45)(20-33)(21-49)(22-51)(23-29)(24-41)(25-37)(26-29)(27-43)(28-45)(29-45)(30-33)(30-50)(31-40)(31-50)(32-38)(32-39)(33-42)(34-46)(34-47)(35-36)(35-43)(36-44)(37-41)(37-44)(38-48)(39-49)(40-42)(41-43)(42-51)(44-45)(46-54)(47-52)(48-53)(49-53)(50-52)(51-55)(52-54)(53-56)(54-56)
Measurements (5)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| MCF-7 | 9.1 | — | 10.1039/C8CC09211G | 2019 |
| A2780cisR | 19 | — | 10.1039/C8CC09211G | 2019 |
| A2780 | 20 | — | 10.1039/C8CC09211G | 2019 |
| CHO | 34 | — | 10.1039/C8CC09211G | 2019 |
| BGM | — | — | 10.1039/C8CC09211G | 2019 |
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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