Ligand id: 8860

Name: aminoethoxyvinylglycine

Abbreviated name: AVG

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 3
Rotatable bonds 5
Topological polar surface area 98.57
Molecular weight 160.08
XLogP -3.66
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Asimakopoulou A, Panopoulos P, Chasapis CT, Coletta C, Zhou Z, Cirino G, Giannis A, Szabo C, Spyroulias GA, Papapetropoulos A. (2013)
Selectivity of commonly used pharmacological inhibitors for cystathionine β synthase (CBS) and cystathionine γ lyase (CSE).
Br. J. Pharmacol., 169 (4): 922-32. [PMID:23488457]