Job Title:title_QQQ15
Job File:没食子酸.sdf
File Link:download

The 'pml' files in the result should be opened inPyMOL2.

Molecular Descriptors:Molecular Weight: 170.02
Lipid-Water partition: 0.5
Number of Hydrogen Bond Acceptors: 4
Number of Hydrogen Bond Donors: 4
Number of Rotatable Bonds: 1
Number of Heavy Atoms: 12
Number of Aliphatic Rings of a Molecular: 0
Number of Aromatic Rings of a Molecular: 1
Topological Polar Suface Area: 97.99
Druglikeness: Excellent
Score:export to excel