Info
| ID | 1092 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 2 |
| Donor atoms | {"N": 8} |
| Abbreviation | 4 |
| SMILES | Cc1ccc2ccc3ccc(C)nc3c2n1.Cc1ccc2ccc3ccc(C)nc3c2n1.Fc1c(F)c(F)c(-c2nc3c4cccnc4c4ncccc4c3[nH]2)c(F)c1F |
TUCAN
C47H31F5N8Ru/(1-36)(2-32)(3-32)(4-38)(5-44)(6-32)(7-33)(8-37)(9-33)(10-40)(11-39)(12-42)(13-48)(14-33)(15-34)(16-34)(17-51)(18-49)(19-60)(20-45)(21-34)(22-35)(23-35)(24-35)(25-59)(26-50)(27-41)(28-43)(29-46)(30-47)(31-80)(32-63)(33-65)(34-68)(35-72)(36-38)(36-52)(37-40)(37-63)(38-53)(39-42)(39-65)(40-52)(41-46)(41-54)(42-53)(43-48)(43-54)(44-45)(44-58)(45-59)(46-56)(47-51)(47-56)(48-68)(49-50)(49-57)(50-60)(51-72)(52-62)(53-64)(54-66)(55-73)(55-76)(55-77)(56-67)(57-69)(57-71)(58-61)(58-70)(59-82)(60-79)(61-71)(61-81)(62-64)(62-83)(63-83)(64-84)(65-84)(66-67)(66-85)(67-86)(68-85)(69-70)(69-79)(70-82)(71-80)(72-86)(73-80)(73-81)(74-75)(74-76)(74-87)(75-78)(75-89)(76-88)(77-78)(77-91)(78-90)(81-92)(82-92)(83-92)(84-92)(85-92)(86-92)
Measurements (5)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| BEL-7402 | 42 | — | 10.1016/j.jinorgbio.2017.04.02... | 2017 |
| HepG2 | 61 | — | 10.1016/j.jinorgbio.2017.04.02... | 2017 |
| A549 | — | — | 10.1016/j.jinorgbio.2017.04.02... | 2017 |
| HeLa | — | — | 10.1016/j.jinorgbio.2017.04.02... | 2017 |
| MG-63 | — | — | 10.1016/j.jinorgbio.2017.04.02... | 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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