Synonyms | |
Status | |
Molecule Category | Free-form |
ATC | V03AB04 |
UNII | YV274KB8PY |
EPA CompTox | DTXSID1044144 |
InChI Key | JBKPUQTUERUYQE-UHFFFAOYSA-O | |
---|---|---|
Smiles | ||
InChI |
|
Property Name | Value | |
---|---|---|
Molecular Formula | C7H9N2O+ | |
Molecular Weight | 137.16 | |
AlogP | 0.32 | |
Hydrogen Bond Acceptor | 2.0 | |
Hydrogen Bond Donor | 1.0 | |
Number of Rotational Bond | 1.0 | |
Polar Surface Area | 36.47 | |
Molecular species | NEUTRAL | |
Aromatic Rings | 1.0 | |
Heavy Atoms | 10.0 |
Resources | Reference | |
---|---|---|
ChEBI | 8354 | |
ChEMBL | CHEMBL1420 | |
DrugBank | DB00733 | |
DrugCentral | 2231 | |
FDA SRS | YV274KB8PY | |
Human Metabolome Database | HMDB0014871 | |
Guide to Pharmacology | 7597 | |
KEGG | C07400 | |
PubChem | 135398747 | |
SureChEMBL | SCHEMBL439968 | |
ZINC | ZINC000004577910 |