L-THREONIC ACID

Search structure
Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 75B0PMW2JF

Structure
InChI Key JPIJQSOTBSSVTP-STHAYSLISA-N
Smile O=C(O)[C@H](O)[C@@H](O)CO
InChI
InChI=1S/C4H8O5/c5-1-2(6)3(7)4(8)9/h2-3,5-7H,1H2,(H,8,9)/t2-,3+/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C4H8O5
Molecular Weight 136.1
AlogP -2.21
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 4.0
Number of Rotational Bond 3.0
Polar Surface Area 97.99
Molecular species ACID
Aromatic Rings 0.0
Heavy Atoms 9.0

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Hydrolase
- - - - 30

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Attention Deficit Disorder with Hyperactivity 2 D001289 ClinicalTrials

Cross References

Resources Reference
ChEBI 15908
ChEMBL CHEMBL2152047
DrugBank DB11192
EPA CompTox DTXSID60223339
FDA SRS 75B0PMW2JF
Human Metabolome Database HMDB0062620
PDB LTH
SureChEMBL SCHEMBL925622
ZINC ZINC000000901061
CONTENTS