Info
| ID | 735 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 2 |
| Donor atoms | {"N": 6} |
| Abbreviation | 4A |
| SMILES | Cc1cc(O)nc(-c2cc(C)cc(O)n2)c1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1 |
TUCAN
C32H28N6O2Ru/(1-49)(2-32)(3-50)(4-35)(5-34)(6-51)(7-31)(8-52)(9-36)(10-37)(11-38)(12-46)(13-29)(14-33)(15-42)(16-39)(17-40)(18-41)(19-29)(20-29)(21-30)(22-45)(23-43)(24-44)(25-30)(26-30)(27-67)(28-68)(29-47)(30-48)(31-32)(31-34)(32-49)(33-47)(33-59)(34-53)(35-36)(35-50)(36-37)(37-54)(38-47)(38-57)(39-42)(39-51)(40-42)(40-55)(41-44)(41-56)(43-44)(43-52)(45-48)(45-60)(46-48)(46-58)(49-61)(50-62)(51-64)(52-65)(53-54)(53-61)(54-62)(55-56)(55-64)(56-65)(57-58)(57-63)(58-66)(59-63)(59-67)(60-66)(60-68)(61-69)(62-69)(63-69)(64-69)(65-69)(66-69)
Measurements (5)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| MOLM-13 | 2.5e+02 | 18 | 10.1021/acs.inorgchem.7b01065 | 2017 |
| MDA-MB-231 | — | 1.1e+03 | 10.1021/acs.inorgchem.7b01065 | 2017 |
| MCF-7 | — | — | 10.1021/acs.inorgchem.7b01065 | 2017 |
| MCF-10A | — | — | 10.1021/acs.inorgchem.7b01065 | 2017 |
| HeLa | — | — | 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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