Job #79 - LTJv3

Created at: Last updated at: Current status:


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 Overall Progress
99.897%
 Ligand Models 1
Name Lopinavir
2D and 3D depictions 2D Depiction of LTJv3 3D Depiction of LTJv3
SMILES Cc1cccc(C)c1OCC(=O)N[C@@H](Cc2ccccc2)[C@@H](O)C[C@H](Cc3ccccc3)NC(=O)[C@H](C(C)C)N4CCCNC4=O
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 Ligand Models 2
Name Cobicistat
2D and 3D depictions 2D Depiction of LTJv3 3D Depiction of LTJv3
SMILES CC(C)c5nc(CN(C)C(=O)N[C@@H](CCN1CCOCC1)C(=O)N[C@H](CC[C@H](Cc2ccccc2)NC(=O)OCc3cncs3)Cc4ccccc4)cs5
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 Ligand Models 3
Name Lisinopril
2D and 3D depictions 2D Depiction of LTJv3 3D Depiction of LTJv3
SMILES NCCCC[C@H](N[C@@H](CCc1ccccc1)C(=O)O)C(=O)N2CCC[C@H]2C(=O)O
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 Ligand Models 4
Name Ramipril
2D and 3D depictions 2D Depiction of LTJv3 3D Depiction of LTJv3
SMILES CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N3[C@H](C(=O)O)C[C@@H]2CCC[C@@H]23
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 Ligand Models 5
Name Moexipril
2D and 3D depictions 2D Depiction of LTJv3 3D Depiction of LTJv3
SMILES CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N3Cc2cc(OC)c(OC)cc2C[C@H]3C(=O)O
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