Info
| ID | 5086 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"N": 7} |
| Abbreviation | MPydMP-Ir |
| SMILES | Cc1cc2nc3c4cccnc4c4nc5ccccn5c4c3nc2cc1C.Cc1cccnc1-c1[c-]cccc1.Cc1cccnc1-c1[c-]cccc1 |
TUCAN
C46H35IrN7/(1-53)(2-46)(3-45)(4-42)(5-37)(6-37)(7-44)(8-37)(9-55)(10-38)(11-57)(12-69)(13-50)(14-38)(15-70)(16-60)(17-36)(18-36)(19-52)(20-48)(21-59)(22-36)(23-47)(24-49)(25-38)(26-43)(27-39)(28-71)(29-68)(30-56)(31-51)(32-54)(33-39)(34-39)(35-58)(36-63)(37-61)(38-65)(39-67)(40-46)(40-62)(41-51)(41-64)(42-44)(42-62)(43-44)(43-46)(45-55)(45-61)(47-67)(47-75)(48-63)(48-74)(49-54)(49-56)(50-57)(50-65)(51-56)(52-60)(52-81)(53-60)(53-68)(54-64)(55-69)(57-70)(58-59)(58-71)(59-66)(61-72)(62-72)(63-67)(64-78)(65-78)(66-73)(66-76)(68-84)(69-85)(70-86)(71-88)(72-85)(73-80)(73-87)(74-75)(74-87)(75-83)(76-79)(76-88)(77-79)(77-80)(77-84)(78-86)(79-82)(80-83)(81-82)(81-84)(85-89)(86-89)(87-89)(88-89)
Measurements (4)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| NCI-H460 | 0.13 | — | 10.1021/acsmedchemlett.9b00337 | 2019 |
| HeLa | 3.9 | — | 10.1021/acsmedchemlett.9b00337 | 2019 |
| T24 | 4.6 | — | 10.1021/acsmedchemlett.9b00337 | 2019 |
| HL-7702 | 57 | — | 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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