Info
| ID | 3855 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 2 |
| Donor atoms | {"N": 6} |
| Abbreviation | Ru1 |
| SMILES | Cc1ccc2ccc3ccc(C)nc3c2n1.Cc1ccc2ccc3ccc(C)nc3c2n1.c1ccc2c(c1)c1ccccc1c1nc3cc4nc5c6cccnc6c6ncccc6c5nc4cc3nc21 |
TUCAN
C60H40N10Ru/(1-49)(2-41)(3-82)(4-64)(5-54)(6-66)(7-58)(8-51)(9-50)(10-41)(11-41)(12-56)(13-52)(14-42)(15-62)(16-59)(17-63)(18-81)(19-68)(20-67)(21-42)(22-55)(23-42)(24-43)(25-70)(26-57)(27-43)(28-69)(29-45)(30-65)(31-48)(32-46)(33-47)(34-53)(35-60)(36-61)(37-43)(38-44)(39-44)(40-44)(41-86)(42-90)(43-99)(44-100)(45-46)(45-63)(46-59)(47-53)(47-71)(48-83)(48-88)(49-51)(49-86)(50-52)(50-73)(51-73)(52-74)(53-54)(54-64)(55-57)(55-75)(56-58)(56-74)(57-76)(58-90)(59-77)(60-62)(60-72)(61-89)(61-91)(62-81)(63-79)(64-78)(65-66)(65-80)(66-82)(67-68)(67-99)(68-75)(69-70)(69-100)(70-76)(71-78)(71-96)(72-84)(72-94)(73-85)(74-87)(75-97)(76-98)(77-79)(77-92)(78-79)(80-93)(80-95)(81-103)(82-104)(83-91)(83-102)(84-95)(84-106)(85-87)(85-105)(86-105)(87-107)(88-89)(88-101)(89-106)(90-107)(91-108)(92-96)(92-102)(93-94)(93-104)(94-103)(95-101)(96-108)(97-98)(97-109)(98-110)(99-109)(100-110)(105-111)(106-111)(107-111)(108-111)(109-111)(110-111)
Measurements (4)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| MG-63 | 1.5 | — | 10.1016/j.jinorgbio.2015.08.01... | 2015 |
| A549 | 1.5 | — | 10.1016/j.jinorgbio.2015.08.01... | 2015 |
| BEL-7402 | 1.6 | — | 10.1016/j.jinorgbio.2015.08.01... | 2015 |
| HeLa | 9 | — | 10.1016/j.jinorgbio.2015.08.01... | 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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