Ligand id: 8518

Name: IS20

Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 9
Topological polar surface area 80.32
Molecular weight 387.16
XLogP 3.37
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Gasser A, Brogi S, Urayama K, Nishi T, Kurose H, Tafi A, Ribeiro N, D├ęsaubry L, Nebigil CG. (2015)
Discovery and cardioprotective effects of the first non-Peptide agonists of the G protein-coupled prokineticin receptor-1.
PLoS ONE, 10 (4): e0121027. [PMID:25831128]