Info
| ID | 732 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 2 |
| Donor atoms | {"N": 6} |
| Abbreviation | 1A |
| SMILES | Oc1cccc(-c2cccc(O)n2)n1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1 |
TUCAN
C30H24N6O2Ru/(1-43)(2-44)(3-25)(4-26)(5-45)(6-46)(7-27)(8-29)(9-28)(10-36)(11-34)(12-30)(13-33)(14-38)(15-39)(16-37)(17-32)(18-31)(19-40)(20-41)(21-42)(22-35)(23-61)(24-62)(25-26)(25-43)(26-30)(27-29)(27-33)(28-34)(28-47)(29-44)(30-48)(31-32)(31-45)(32-38)(33-49)(34-36)(35-37)(35-42)(36-53)(37-54)(38-50)(39-41)(39-51)(40-41)(40-46)(42-52)(43-55)(44-56)(45-57)(46-60)(47-52)(47-58)(48-49)(48-55)(49-56)(50-51)(50-57)(51-60)(52-59)(53-58)(53-61)(54-59)(54-62)(55-63)(56-63)(57-63)(58-63)(59-63)(60-63)
Measurements (6)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| HeLa | 88 | — | 10.1016/j.jinorgbio.2013.10.00... | 2014 |
| HeLa | 1.5e+02 | 2e+02 | 10.1021/acs.inorgchem.7b01065 | 2017 |
| MDA-MB-231 | 1e+03 | 2.9e+02 | 10.1021/acs.inorgchem.7b01065 | 2017 |
| MCF-7 | — | — | 10.1021/acs.inorgchem.7b01065 | 2017 |
| MCF-10A | — | 2.1e+02 | 10.1021/acs.inorgchem.7b01065 | 2017 |
| MOLM-13 | — | — | 10.1021/acs.inorgchem.7b01065 | 2017 |
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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