Job Title:title_QQQ19
Job File:原花青素B3.sdf
File Link:download

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

Molecular Descriptors:Molecular Weight: 578.14
Lipid-Water partition: 3
Number of Hydrogen Bond Acceptors: 12
Number of Hydrogen Bond Donors: 10
Number of Rotatable Bonds: 3
Number of Heavy Atoms: 42
Number of Aliphatic Rings of a Molecular: 2
Number of Aromatic Rings of a Molecular: 4
Topological Polar Suface Area: 220.76
Druglikeness: Maybe bad
Score:export to excel