JPC-3210

Ligand id: 10395

Name: JPC-3210

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 2
Rotatable bonds 6
Topological polar surface area 45.15
Molecular weight 398.2
XLogP 6.54
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Ligand families/groups Antimalarial ligands
IUPAC Name
4-tert-butyl-2-[(tert-butylamino)methyl]-6-[5-fluoro-6-(trifluoromethyl)pyridin-3-yl]phenol
Synonyms
MMV892646
Database Links
CAS Registry No. 1609655-35-7 (source: Scifinder)
PubChem CID 90122671
Search Google for chemical match using the InChIKey DYULPLHABFGTOQ-UHFFFAOYSA-N
Search Google for chemicals with the same backbone DYULPLHABFGTOQ
Search UniChem for chemical match using the InChIKey DYULPLHABFGTOQ-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone DYULPLHABFGTOQ