Info
| ID | 739 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 2 |
| Donor atoms | {"N": 7} |
| Abbreviation | GRPA |
| SMILES | Cc1ccnc(-c2cc(C(=O)Nc3ccc4cc5ccccc5cc4c3)ccn2)c1.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12 |
TUCAN
C50H35N7ORu/(1-46)(2-72)(3-73)(4-76)(5-40)(6-61)(7-77)(8-53)(9-60)(10-47)(11-44)(12-41)(13-43)(14-36)(15-75)(16-45)(17-55)(18-56)(19-59)(20-49)(21-52)(22-51)(23-74)(24-57)(25-36)(26-36)(27-37)(28-38)(29-50)(30-54)(31-58)(32-39)(33-48)(34-42)(35-86)(36-65)(37-42)(37-62)(38-39)(38-63)(39-64)(40-41)(40-72)(41-62)(42-69)(43-44)(43-63)(44-73)(45-65)(45-75)(46-71)(46-81)(47-68)(47-70)(48-67)(48-84)(49-66)(49-67)(50-71)(50-74)(51-55)(51-64)(52-54)(52-66)(53-60)(53-70)(54-58)(55-76)(56-57)(56-77)(57-69)(58-61)(59-65)(59-80)(60-84)(61-68)(62-78)(63-79)(64-82)(66-68)(67-70)(69-83)(71-85)(72-87)(73-89)(74-92)(75-88)(76-90)(77-91)(78-83)(78-87)(79-82)(79-89)(80-81)(80-88)(81-92)(82-90)(83-91)(84-86)(85-86)(85-93)(87-94)(88-94)(89-94)(90-94)(91-94)(92-94)
Measurements (4)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| A2780 | 1.5 | 0.23 | 10.1021/acs.inorgchem.4c02235 | 2024 |
| MDA-MB-231 | 2 | 0.39 | 10.1021/acs.inorgchem.4c02235 | 2024 |
| A549 | 6.1 | 1 | 10.1021/acs.inorgchem.4c02235 | 2024 |
| MRC-5 | 14 | 0.34 | 10.1021/acs.inorgchem.4c02235 | 2024 |
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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