afegostat

Ligand id: 7410

Name: afegostat

Abbreviated name: IFM

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 4
Rotatable bonds 1
Topological polar surface area 72.72
Molecular weight 147.09
XLogP -0.49
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(3R,4R,5R)-5-(HYDROXYMETHYL)PIPERIDINE-3,4-DIOL
International Nonproprietary Names
INN number INN
9004 afegostat
Synonyms
iso-fagomine
isofagomine
Database Links
CAS Registry No. 169105-89-9
ChEMBL Ligand CHEMBL206468
DrugBank Ligand DB04545
PubChem CID 447607
RCSB PDB Ligand IFM
Search Google for chemical match using the InChIKey QPYJXFZUIJOGNX-HSUXUTPPSA-N
Search Google for chemicals with the same backbone QPYJXFZUIJOGNX
Search PubMed clinical trials afegostat
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Wikipedia Isofagomine tartrate