Job #83 - LTJv7

Created at: Last updated at: Current status:


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 Overall Progress
100.000%
 Ligand Models 1
Name Bictegravir
2D and 3D depictions 2D Depiction of LTJv7 3D Depiction of LTJv7
SMILES O=C(NCc1c(F)cc(F)cc1F)c5cn4C[C@H]3O[C@@H]2CC[C@@H](C2)N3C(=O)c4c(O)c5=O
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 Ligand Models 2
Name Darunavir
2D and 3D depictions 2D Depiction of LTJv7 3D Depiction of LTJv7
SMILES CC(C)CN(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)O[C@H]2CO[C@H]3OCC[C@@H]23)S(=O)(=O)c4ccc(N)cc4
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 Ligand Models 3
Name Baloxavir marboxil
2D and 3D depictions 2D Depiction of LTJv7 3D Depiction of LTJv7
SMILES COC(=O)OCOc6c5C(=O)N1CCOC[C@H]1N([C@@H]4c2ccccc2SCc3c(F)c(F)ccc34)n5ccc6=O
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 Ligand Models 4
Name Simeprevir
2D and 3D depictions 2D Depiction of LTJv7 3D Depiction of LTJv7
SMILES COc7ccc6c(O[C@@H]4C[C@@H]3C(=O)N[C@]2(C(=O)NS(=O)(=O)C1CC1)C[C@H]2/C=C\CCCCN(C)C(=O)[C@@H]3C4)cc(c5nc(C(C)C)cs5)nc6c7C
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 Ligand Models 5
Name Adefovir dipivoxil
2D and 3D depictions 2D Depiction of LTJv7 3D Depiction of LTJv7
SMILES CC(C)(C)C(=O)OCOP(=O)(COCCn2cnc1c(N)ncnc12)OCOC(=O)C(C)(C)C
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