apratastat

Ligand id: 6482

Name: apratastat

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 3
Rotatable bonds 6
Topological polar surface area 149.85
Molecular weight 414.09
XLogP 0.97
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(3S)-N-hydroxy-4-[4-(4-hydroxybut-2-ynoxy)phenyl]sulfonyl-2,2-dimethylthiomorpholine-3-carboxamide
International Nonproprietary Names
INN number INN
8578 apratastat
Synonyms
TMI-05
Database Links
CAS Registry No. 287405-51-0 (source: PubChem)
ChEMBL Ligand CHEMBL206815
PubChem CID 11452716
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