Synonyms: | |
Status: | Approved (1996) |
Entry Type: | Small molecule |
Molecule Category: | Parent Prodrug |
ATC: | C01CA17 |
UNII: | 6YE7PBM15H |
InChI Key | PTKSEFOSCHHMPD-UHFFFAOYSA-N |
---|---|
Smile | |
InChI |
|
Property Name | Value |
---|---|
Molecular Formula | C12H18N2O4 |
Molecular Weight | 254.29 |
AlogP | -0.19 |
Hydrogen Bond Acceptor | 5.0 |
Hydrogen Bond Donor | 3.0 |
Number of Rotational Bond | 6.0 |
Polar Surface Area | 93.81 |
Molecular species | NEUTRAL |
Aromatic Rings | 1.0 |
Heavy Atoms | 18.0 |
Mesh Heading | Maximum Phase | Mesh ID | Reference |
---|---|---|---|
Hypotension | 3 | D007022 | ClinicalTrials |
Shock, Septic | 3 | D012772 | ClinicalTrials |
Spinal Cord Injuries | 3 | D013119 | ClinicalTrials |
Ascites | 3 | D001201 | ClinicalTrials |
Ischemic Stroke | 2 | D000083242 | ClinicalTrials |
Hypotension, Orthostatic | 2 | D007024 | ClinicalTrials |
Hepatopulmonary Syndrome | 1 | D020065 | ClinicalTrials |
Resources | Reference |
---|---|
CAS NUMBER | 42794-76-3 |
ChEBI | 6933 |
ChEMBL | CHEMBL1201212 |
DrugBank | DB00211 |
DrugCentral | 1803 |
EPA CompTox | DTXSID0023321 |
FDA SRS | 6YE7PBM15H |
Human Metabolome Database | HMDB0014356 |
Guide to Pharmacology | 7240 |
KEGG | C07890 |
PharmGKB | PA164749381 |
PubChem | 4195 |
SureChEMBL | SCHEMBL131436 |