compound 33 [PMID: 26230603]

Ligand id: 8732

Name: compound 33 [PMID: 26230603]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 3
Rotatable bonds 5
Topological polar surface area 117.8
Molecular weight 420.18
XLogP 1
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

View interactive charts of activity data from ChEMBL and GtoPdb across species (New!)

Selectivity at human enzymes
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Target Type Action Affinity Units Concentration range (M) Reference
ATPase family, AAA domain containing 2 Inhibitor Inhibition 5.3 pIC50 - 1
pIC50 5.3 [1]