Info
| ID | 3415 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 1 |
| Donor atoms | {"N": 3} |
| Abbreviation | 2 |
| SMILES | CCOC(=O)CCCCN(c1ccccn1)c1ccccn1.Cc1ccc(C(C)C)cc1.[Cl-] |
TUCAN
C27H35N3O2Ru/(1-56)(2-36)(3-42)(4-36)(5-40)(6-41)(7-36)(8-37)(9-46)(10-48)(11-37)(12-55)(13-43)(14-38)(15-37)(16-58)(17-58)(18-52)(19-61)(20-39)(21-39)(22-61)(23-39)(24-50)(25-50)(26-51)(27-51)(28-49)(29-57)(30-38)(31-38)(32-44)(33-47)(34-45)(35-52)(36-55)(37-55)(38-54)(39-61)(40-42)(40-53)(41-48)(41-53)(42-54)(43-46)(43-59)(44-46)(44-56)(45-47)(45-57)(47-49)(48-54)(49-60)(50-51)(50-58)(51-52)(52-62)(53-55)(56-64)(57-65)(58-63)(59-63)(59-64)(60-63)(60-65)(61-67)(62-66)(62-67)(64-68)(65-68)(67-68)
Measurements (5)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| MCF-7 | 1.8e+02 | — | 10.1016/j.jinorgbio.2015.09.00... | 2015 |
| 518A2 | — | — | 10.1016/j.jinorgbio.2015.09.00... | 2015 |
| SW480 | — | — | 10.1016/j.jinorgbio.2015.09.00... | 2015 |
| 8505C | — | — | 10.1016/j.jinorgbio.2015.09.00... | 2015 |
| A253 | — | — | 10.1016/j.jinorgbio.2015.09.00... | 2015 |
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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