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CoViProteins
2019-nCoV
CoViLigands
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2019-nCoV
D3Docking
Job Title:
title_220521095648
Job File:
liangsdf.sdf
File Link:
download
Note:
The 'pml' files in the result should be opened in
PyMOL2
.
Molecular Descriptors:
Molecular Weight: 547.35
Lipid-Water partition: 4.77
Number of Hydrogen Bond Acceptors: 5
Number of Hydrogen Bond Donors: 3
Number of Rotatable Bonds: 9
Number of Heavy Atoms: 40
Number of Aliphatic Rings of a Molecular: 2
Number of Aromatic Rings of a Molecular: 2
Topological Polar Suface Area: 95.86
Druglikeness: Good
Score:
export to excel
Rank
Target Full Name
State
Score
ProteinID
Pocket
Organism
Model Source
Rank
a