Job #187 - Digoxin+Proscillaridin+Eltrombopag

Created at: Last updated at: Current status:


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 Overall Progress
100.000%
 Ligand Models 1
Name Digoxin
2D and 3D depictions 2D Depiction of Digoxin+Proscillaridin+Eltrombopag 3D Depiction of Digoxin+Proscillaridin+Eltrombopag
SMILES C[C@H]8O[C@@H](O[C@@H]7[C@@H](C)O[C@@H](O[C@@H]6C(C)O[C@@H](O[C@H]5CC[C@@]1(C)[C@H](CC[C@@H]3[C@@H]1C[C@@H](O)[C@]4(C)[C@@H](/C2=C/C(=O)OC2)CC[C@]34O)C5)C[C@@H]6O)C[C@@H]7O)C[C@H](O)[C@@H]8O
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 Ligand Models 2
Name Proscillaridin
2D and 3D depictions 2D Depiction of Digoxin+Proscillaridin+Eltrombopag 3D Depiction of Digoxin+Proscillaridin+Eltrombopag
SMILES C[C@@H]6O[C@@H](O[C@@H]5/C=C\4CC[C@@H]2[C@H](CC[C@]3(C)[C@@H](c1ccc(=O)oc1)CC[C@]23O)[C@@]4(C)CC5)[C@H](O)[C@H](O)[C@H]6O
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 Ligand Models 3
Name Eltrombopag
2D and 3D depictions 2D Depiction of Digoxin+Proscillaridin+Eltrombopag 3D Depiction of Digoxin+Proscillaridin+Eltrombopag
SMILES Cc4ccc(n3nc(C)c(=NNc2cccc(c1cccc(C(=O)O)c1)c2O)c3=O)cc4C
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