Synonyms: | |
Status: | Phase 1 |
Entry Type: | Small molecule |
Molecule Category: | UNKNOWN |
UNII: | 8D4SNN7V92 |
InChI Key | ZTHYODDOHIVTJV-UHFFFAOYSA-N |
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Smile | |
InChI |
|
Property Name | Value |
---|---|
Molecular Formula | C10H12O5 |
Molecular Weight | 212.2 |
AlogP | 1.37 |
Hydrogen Bond Acceptor | 5.0 |
Hydrogen Bond Donor | 3.0 |
Number of Rotational Bond | 3.0 |
Polar Surface Area | 86.99 |
Molecular species | NEUTRAL |
Aromatic Rings | 1.0 |
Heavy Atoms | 15.0 |
Resources | Reference |
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ChEBI | 10607 |
ChEMBL | CHEMBL7983 |
DrugBank | DB12450 |
EPA CompTox | DTXSID5021201 |
FDA SRS | 8D4SNN7V92 |
Human Metabolome Database | HMDB0033835 |
KEGG | C11155 |
PubChem | 4947 |
SureChEMBL | SCHEMBL22630 |
ZINC | ZINC000001532172 |