MIGALASTAT

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Synonyms
Status
Molecule Category Free-form
ATC A16AX14
UNII C4XNY919FW

Structure

InChI Key LXBIFEVIBLOUGU-DPYQTVNSSA-N
Smiles OC[C@H]1NC[C@H](O)[C@@H](O)[C@H]1O
InChI
InChI=1S/C6H13NO4/c8-2-3-5(10)6(11)4(9)1-7-3/h3-11H,1-2H2/t3-,4+,5+,6-/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H13NO4
Molecular Weight 163.17
AlogP -2.97
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 5.0
Number of Rotational Bond 1.0
Polar Surface Area 92.95
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 11.0

Pharmacology

Mechanism of Action Action Reference
Alpha-galactosidase A stabiliser STABILISER Other
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Hydrolase
- 3-70 - 13 89
Enzyme
- 3-70 - 13 89
EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Coffea arabica
- 3-3 - 13 -
Homo sapiens
- 13-80 - - 89

Target Conservation

Protein: Alpha-galactosidase A
Description: Alpha-galactosidase A
Organism : Homo sapiens
P06280 ENSG00000102393

Related Entries

Cross References

Resources Reference
ChEBI 135923
ChEMBL CHEMBL110458
DrugBank DB05018
DrugCentral 5110
FDA SRS C4XNY919FW
Guide to Pharmacology 10200
PDB DGJ
PubChem 176077
SureChEMBL SCHEMBL1479364
ZINC ZINC000001636704
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