Compound 34c [PMID 24641010]

Ligand id: 9647

Name: Compound 34c [PMID 24641010]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 5
Topological polar surface area 106.24
Molecular weight 423.17
XLogP 3.89
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

Bioactivity Comments
The antiparasite activitity of compound 34c against the asexual blood stage and liver stage of the Plasmodium lifecycle is provided in the interaction table below. For the asexual blood stage evaluation, a panel of culture-adapted P. falciparum strains was used with no evidence of reduced potency against drug resistant strains.
Selectivity at other protein targets
Key to terms and symbols Click on species/strain names for details Click column headers to sort
Target Sp. Type Action Affinity Units Concentration range (M) Reference
Plasmodium falciparum N-Myristoyltransferase Pf3D7 Inhibitor Inhibition 8.1 pKi - 2
pKi 8.1 (Ki 8x10-9 M) [2]
Description: Enzyme inhibition assay
Whole organism assay data
Key to terms and symbols Click on species/strain names for details Click column headers to sort
MOA/likely target Sp. Assay description Type Action Affinity Units Concentration range (M) Reference
Plasmodium falciparum N-Myristoyltransferase PfNF54 Parasite growth inhibition assay - - 6.6 pEC50 - 2
pEC50 6.6 (EC50 2.32x10-7 M) [3H]-hypoxanthine incorporation [2]
Lifecycle stages: Plasmodium asexual blood stage (erythrocytic merozoite, trophozoite, erythrocytic schizont)
Plasmodium falciparum N-Myristoyltransferase Pf3D7 Parasite growth inhibition assay - - 6.5 pEC50 - 2
pEC50 6.5 (EC50 3.02x10-7 M) [3H]-hypoxanthine incorporation [2]
Lifecycle stages: Plasmodium asexual blood stage (erythrocytic merozoite, trophozoite, erythrocytic schizont)
Plasmodium falciparum N-Myristoyltransferase PfK1 Parasite growth inhibition assay - - 6.5 pEC50 - 2
pEC50 6.5 (EC50 3.39x10-7 M) [3H]-hypoxanthine incorporation [2]
Lifecycle stages: Plasmodium asexual blood stage (erythrocytic merozoite, trophozoite, erythrocytic schizont)
Plasmodium falciparum N-Myristoyltransferase Pb Parasite liver stage assay - - 6.4 pEC50 - 2
pEC50 6.4 (EC50 3.72x10-7 M) Luciferase bioluminescence assay to measure viability of exoerythrocytic forms (EEF) [2]
Lifecycle stages: Plasmodium liver stage (sporozoite, hepatic schizont, hepatic merozoite)
Plasmodium falciparum N-Myristoyltransferase PfDd2 Parasite growth inhibition assay - - 6.0 pEC50 - 2
pEC50 6.0 (EC50 9.16x10-7 M) [3H]-hypoxanthine incorporation [2]
Lifecycle stages: Plasmodium asexual blood stage (erythrocytic merozoite, trophozoite, erythrocytic schizont)