MIGLUSTAT

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Trade Names
Synonyms
Status
Molecule Category Free-form
ATC A16AX06
UNII ADN3S497AZ
EPA CompTox DTXSID6045618

Structure

InChI Key UQRORFVVSGFNRO-UTINFBMNSA-N
Smiles CCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO
InChI
InChI=1S/C10H21NO4/c1-2-3-4-11-5-8(13)10(15)9(14)7(11)6-12/h7-10,12-15H,2-6H2,1H3/t7-,8+,9-,10-/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C10H21NO4
Molecular Weight 219.28
AlogP -1.45
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 4.0
Number of Rotational Bond 4.0
Polar Surface Area 84.16
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 15.0

Pharmacology

Mechanism of Action Action Reference
Ceramide glucosyltransferase inhibitor INHIBITOR DailyMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Hydrolase
- 100-100 - 200 -
Enzyme
- 14-600 - 200 70
EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Homo sapiens
- 14-230 - 200 70
Mus musculus
- 140-600 - - -
rice
- 420 - - -

Target Conservation

Protein: Ceramide glucosyltransferase
Description: Ceramide glucosyltransferase
Organism : Homo sapiens
Q16739 ENSG00000148154

Related Entries

Cross References

Resources Reference
ChEBI 50381
ChEMBL CHEMBL1029
DrugBank DB00419
DrugCentral 1807
FDA SRS ADN3S497AZ
Human Metabolome Database HMDB0014563
Guide to Pharmacology 4841
KEGG D05032
PDB NBV
PharmGKB PA10140
PubChem 51634
SureChEMBL SCHEMBL246893
ZINC ZINC000003794711
CONTENTS