Synonyms | |
Status | |
Molecule Category | Free-form |
ATC | C09AA08 |
UNII | 8Q9454114Q |
EPA CompTox | DTXSID1048629 |
InChI Key | HHHKFGXWKKUNCY-FHWLQOOXSA-N | |
---|---|---|
Smiles | ||
InChI |
|
Property Name | Value | |
---|---|---|
Molecular Formula | C22H31N3O5 | |
Molecular Weight | 417.51 | |
AlogP | 1.6 | |
Hydrogen Bond Acceptor | 6.0 | |
Hydrogen Bond Donor | 2.0 | |
Number of Rotational Bond | 8.0 | |
Polar Surface Area | 99.18 | |
Molecular species | ACID | |
Aromatic Rings | 1.0 | |
Heavy Atoms | 30.0 |
Resources | Reference | |
---|---|---|
ChEBI | 3698 | |
ChEMBL | CHEMBL515606 | |
DrugBank | DB01340 | |
DrugCentral | 641 | |
FDA SRS | 8Q9454114Q | |
Human Metabolome Database | HMDB0015433 | |
Guide to Pharmacology | 6459 | |
SureChEMBL | SCHEMBL24962 | |
ZINC | ZINC000003781951 |