compound 30 [PMID: 22468970]

Ligand id: 8885

Name: compound 30 [PMID: 22468970]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 8
Topological polar surface area 82.91
Molecular weight 495.06
XLogP 6.69
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

1. Wang D, Chu PC, Yang CN, Yan R, Chuang YC, Kulp SK, Chen CS. (2012)
Development of a novel class of glucose transporter inhibitors.
J. Med. Chem., 55 (8): 3827-36. [PMID:22468970]