Info
| ID | 3778 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 2 |
| Donor atoms | {"N": 7} |
| Abbreviation | 3 |
| SMILES | Cc1ccnc2c1ccc1c(C)ccnc12.Cc1ccnc2c1ccc1c(C)ccnc12.O=C1c2ccccc2C(=O)c2c1ccc1nc(-c3ccccn3)[nH]c21 |
TUCAN
C48H35N7O2Ru/(1-36)(2-54)(3-36)(4-36)(5-37)(6-49)(7-37)(8-37)(9-38)(10-51)(11-38)(12-55)(13-42)(14-41)(15-38)(16-39)(17-39)(18-69)(19-40)(20-39)(21-52)(22-47)(23-70)(24-53)(25-45)(26-71)(27-43)(28-50)(29-46)(30-56)(31-72)(32-44)(33-73)(34-48)(35-84)(36-57)(37-61)(38-64)(39-67)(40-47)(40-59)(41-46)(41-58)(42-43)(42-60)(43-62)(44-48)(44-63)(45-50)(45-69)(46-47)(48-68)(49-55)(49-75)(50-54)(51-57)(51-70)(52-61)(52-71)(53-64)(53-72)(54-80)(55-65)(56-67)(56-73)(57-60)(58-59)(58-83)(59-82)(60-74)(61-62)(62-76)(63-64)(63-77)(65-66)(65-82)(66-79)(66-83)(67-68)(68-78)(69-85)(70-87)(71-88)(72-89)(73-90)(74-76)(74-87)(75-79)(75-86)(76-88)(77-78)(77-89)(78-90)(79-84)(80-81)(80-85)(81-84)(81-86)(82-91)(83-92)(85-93)(86-93)(87-93)(88-93)(89-93)(90-93)
Measurements (5)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| HeLa | 12 | — | 10.1039/c3mt20270d | 2013 |
| BEL-7402 | 20 | — | 10.1039/c3mt20270d | 2013 |
| HepG2 | 25 | — | 10.1039/c3mt20270d | 2013 |
| A549 | 32 | — | 10.1039/c3mt20270d | 2013 |
| LO2 | 99 | — | 10.1039/c3mt20270d | 2013 |
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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