Job #382 - Ivermectin

Created at: Last updated at: Current status:

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 Overall Progress
74.603%
 Ligand Models
Name Ivermectin
2D and 3D depictions 2D Depiction of Ivermectin 3D Depiction of Ivermectin
SMILES CC[C@H](C)[C@H]1O[C@]7(CC[C@@H]1C)C[C@@H]4C[C@@H](C/C=C(C)/[C@@H](O[C@H]3C[C@H](OC)[C@@H](O[C@H]2C[C@H](OC)[C@@H](O)[C@H](C)O2)[C@H](C)O3)[C@@H](C)/C=C/C=C/5CO[C@@H]6C(O)/C(C)=C\C(C(=O)O4)C56O)O7.CO[C@H]7C[C@H](O[C@H]6[C@H](C)O[C@@H](O[C@@H]3/C(C)=C/C[C@H]2C[C@@H](C[C@]1(CC[C@H](C)[C@@H](C(C)C)O1)O2)OC(=O)[C@H]4/C=C(C)\[C@@H](O)[C@H]5OC/C(=C/C=C/[C@@H]3C)[C@@]45O)C[C@@H]6OC)O[C@@H](C)[C@@H]7O
Model downloads
SMILES Protein Data Bank AutoDock PDBQT Sybyl Mol2 MDL MOL
Fingerprints
MACCS FP2 FP3 FP4 ECFP0 ECFP2 ECFP4 ECFP6 ECFP8 ECFP10