SC83288

Ligand id: 10175

Name: SC83288

Structure and Physico-chemical Properties

2D Structure
Click here for structure editor
Calculated Physico-chemical Properties
Hydrogen bond acceptors 14
Hydrogen bond donors 5
Rotatable bonds 13
Topological polar surface area 220.85
Molecular weight 629.17
XLogP 1.86
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Ligand families/groups Antimalarial ligands
IUPAC Name
methyl 4-[3-[[4-[(4-sulfamoylphenyl)methylsulfamoyl]phenyl]carbamoylamino]benzenecarboximidoyl]piperazine-1-carboxylate
Comments
SC83288 is an amicarbalide derivative and the clinical development candidate for this novel antimalarial chemotype [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 381118885
PubChem CID 57496162
Search Google for chemical match using the InChIKey UJKWTQWUYKHLGQ-UHFFFAOYSA-N
Search Google for chemicals with the same backbone UJKWTQWUYKHLGQ
Search UniChem for chemical match using the InChIKey UJKWTQWUYKHLGQ-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone UJKWTQWUYKHLGQ