Menu

D3Docking

D3Similarity

D3AI-CoV

D3Pockets

D3AI-Spike

CoViProteins

CoViLigands

D3Docking

Job Title:title_220613120730
Job File:3CL苯丙氨酸.sdf
File Link:download

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

Molecular Descriptors:Molecular Weight: 442.17
Lipid-Water partition: 1.93
Number of Hydrogen Bond Acceptors: 5
Number of Hydrogen Bond Donors: 4
Number of Rotatable Bonds: 8
Number of Heavy Atoms: 33
Number of Aliphatic Rings of a Molecular: 0
Number of Aromatic Rings of a Molecular: 4
Topological Polar Suface Area: 111.65
Druglikeness: Excellent
Score:export to excel