compound 5 [PMID: 30894487]

Ligand id: 10398

Name: compound 5 [PMID: 30894487]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 4
Topological polar surface area 79.54
Molecular weight 355.1
XLogP 3.64
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Ligand families/groups Antimalarial ligands
IUPAC Name
N-[(4,4-difluoro-1-hydroxycyclohexyl)methyl]-6-fluoro-4-oxochromene-2-carboxamide
Database Links
PubChem CID 134158252
RCSB PDB Ligand FYB
Search Google for chemical match using the InChIKey PJBRCGHQNUWERQ-UHFFFAOYSA-N
Search Google for chemicals with the same backbone PJBRCGHQNUWERQ
Search UniChem for chemical match using the InChIKey PJBRCGHQNUWERQ-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone PJBRCGHQNUWERQ