Job #93 - LTJv17

Created at: Last updated at: Current status:


See Detailed Output Download CSV

 Overall Progress
100.000%
 Ligand Models 1
Name 1-deoxymannojirimycin
2D and 3D depictions 2D Depiction of LTJv17 3D Depiction of LTJv17
SMILES OC[C@H]1NC[C@@H](O)C(O)[C@H]1O
Model downloads
Fingerprints
 Ligand Models 2
Name Etravirine
2D and 3D depictions 2D Depiction of LTJv17 3D Depiction of LTJv17
SMILES Cc1cc(C#N)cc(C)c1Oc3nc(Nc2ccc(C#N)cc2)nc(N)c3Br
Model downloads
Fingerprints
 Ligand Models 3
Name Amprenavir
2D and 3D depictions 2D Depiction of LTJv17 3D Depiction of LTJv17
SMILES CC(C)CN(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)O[C@H]2CCOC2)S(=O)(=O)c3ccc(N)cc3
Model downloads
Fingerprints
 Ligand Models 4
Name Letermovir
2D and 3D depictions 2D Depiction of LTJv17 3D Depiction of LTJv17
SMILES COc5cccc(N4CCN(/C2=N/c1c(F)cccc1[C@H](CC(=O)O)N2c3cc(C(F)(F)F)ccc3OC)CC4)c5
Model downloads
Fingerprints
 Ligand Models 5
Name Tipranavir
2D and 3D depictions 2D Depiction of LTJv17 3D Depiction of LTJv17
SMILES CCC[C@@]4(CCc1ccccc1)C/C(O)=C([C@H](CC)c3cccc(NS(=O)(=O)c2ccc(C(F)(F)F)cn2)c3)\C(=O)O4
Model downloads
Fingerprints