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

1. Leatherbarrow et al.. (2013)
Novel compounds and their use in therapy.
Patent number: WO2013083991. Assignee: Imperial Innovations. Priority date: 19/08/2017. Publication date: 19/08/2017.
2. Rackham MD, Brannigan JA, Rangachari K, Meister S, Wilkinson AJ, Holder AA, Leatherbarrow RJ, Tate EW. (2014)
Design and synthesis of high affinity inhibitors of Plasmodium falciparum and Plasmodium vivax N-myristoyltransferases directed by ligand efficiency dependent lipophilicity (LELP).
J. Med. Chem., 57 (6): 2773-88. [PMID:24641010]