Job Title:title_QQQ17
Job File:原花青素.sdf
File Link:download

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

Molecular Descriptors:Molecular Weight: 594.14
Lipid-Water partition: 2.73
Number of Hydrogen Bond Acceptors: 13
Number of Hydrogen Bond Donors: 10
Number of Rotatable Bonds: 4
Number of Heavy Atoms: 43
Number of Aliphatic Rings of a Molecular: 2
Number of Aromatic Rings of a Molecular: 4
Topological Polar Suface Area: 229.99
Druglikeness: Maybe bad
Score:export to excel