Structure

InChI Key SHZGCJCMOBCMKK-DHVFOXMCSA-N
Smile C[C@@H]1OC(O)[C@@H](O)[C@H](O)[C@@H]1O
InChI
InChI=1S/C6H12O5/c1-2-3(7)4(8)5(9)6(10)11-2/h2-10H,1H3/t2-,3+,4+,5-,6?/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H12O5
Molecular Weight 164.16
AlogP -2.19
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 4.0
Number of Rotational Bond 0.0
Polar Surface Area 90.15
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 11.0

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Protease Serine protease Serine protease PA clan Serine protease S1A subfamily
- - - - 20
Unclassified protein
- 910-2740 - - -

Indications

Mesh Heading Maximum Phase Reference
Tissue Adhesions Phase 1/Phase 2 ClinicalTrials

Cross References

Resources Reference
ChEBI 2181
ChEMBL CHEMBL469449
FDA SRS 28RYY2IV3F
Guide to Pharmacology 4721
KEGG C01019
SureChEMBL SCHEMBL63943