phosphoenolpyruvic acid

Ligand id: 4692

Name: phosphoenolpyruvic acid

Abbreviated name: PEP

Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 3
Rotatable bonds 3
Topological polar surface area 113.87
Molecular weight 167.98
XLogP -1.3
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

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

Transporters Moving this Compound Across a Lipid Membrane
Transporter EC number Reaction Reference
Mitochondrial citrate transporter
Selectivity at enzymes
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Target Sp. Type Action Value Parameter Concentration range (M) Reference
peptidase D Pig Inhibitor Inhibition 9.5 – 9.6 pKi - 1
⤷ pKi 9.5 – 9.6 (Ki 3x10-10 – 2.4x10-10 M) [1]
Description: Biphasic inhibition of purified enzyme from pig kidney.