UCT943

Ligand id: 10093

Name: UCT943

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 5
Topological polar surface area 84.14
Molecular weight 427.16
XLogP 3.36
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Ligand families/groups Antimalarial ligands
IUPAC Name
[4-[5-amino-6-[4-(trifluoromethyl)phenyl]pyrazin-2-yl]phenyl]-piperazin-1-ylmethanone
Comments
UCT943 was identified from a SAR study of the 2-aminopyridines, a class of small molecules with promising antimalarial activity [2].

The Malaria tab on this ligand page provides additional curator comments of relevance to the Guide to MALARIA PHARMACOLOGY.
Database Links
GtoPdb PubChem SID 381118803
PubChem CID 71711915
Search Google for chemical match using the InChIKey GGOFGCMPKAWHEZ-UHFFFAOYSA-N
Search Google for chemicals with the same backbone GGOFGCMPKAWHEZ
Search UniChem for chemical match using the InChIKey GGOFGCMPKAWHEZ-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone GGOFGCMPKAWHEZ