Ligand id: 5147

Name: BAY607550

Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 10
Topological polar surface area 101.74
Molecular weight 476.24
XLogP 5.72
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

View interactive charts of activity data from GtoPdb and ChEMBL (where available) across species

Selectivity at enzymes
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Target Sp. Type Action Value Parameter Concentration range (M) Reference
phosphodiesterase 2A Hs Inhibitor Inhibition 8.3 – 8.8 pIC50 - 1
pIC50 8.3 – 8.8 (IC50 5.01x10-9 – 1.58x10-9 M) [1]