Info
| ID | 5090 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"N": 7} |
| Abbreviation | PyMP-Ir |
| SMILES | Cc1ccc2nc3c4ncccc4c4nc5ccccc5nc4c3n2c1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1 |
TUCAN
C43H29IrN7/(1-39)(2-37)(3-33)(4-46)(5-59)(6-35)(7-43)(8-34)(9-62)(10-36)(11-48)(12-60)(13-30)(14-61)(15-53)(16-54)(17-40)(18-45)(19-44)(20-49)(21-30)(22-52)(23-42)(24-41)(25-47)(26-38)(27-50)(28-51)(29-30)(30-56)(31-46)(31-55)(32-50)(32-57)(33-34)(33-37)(34-46)(35-45)(35-59)(36-44)(36-48)(37-55)(38-45)(38-63)(39-52)(39-56)(40-47)(40-66)(41-54)(41-68)(42-53)(42-61)(43-49)(43-60)(44-50)(47-54)(48-57)(49-51)(51-64)(52-72)(53-58)(55-63)(56-62)(57-64)(58-65)(58-70)(59-76)(60-77)(61-78)(62-75)(63-76)(64-77)(65-71)(65-74)(66-68)(66-73)(67-69)(67-70)(67-79)(68-74)(69-71)(69-75)(70-78)(71-73)(72-75)(72-79)(76-80)(77-80)(78-80)(79-80)
Measurements (4)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| NCI-H460 | 2.5 | — | 10.1021/acsmedchemlett.9b00337 | 2019 |
| HeLa | 12 | — | 10.1021/acsmedchemlett.9b00337 | 2019 |
| T24 | 20 | — | 10.1021/acsmedchemlett.9b00337 | 2019 |
| HL-7702 | 50 | — | 10.1021/acsmedchemlett.9b00337 | 2019 |
🧬 Cell Death Types (1)
Apoptosis
high
«apoptosis induction was seen in 38.7% of MPydMP-Ir treated cells (Figure 1).»
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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