Keyword(s): Human Metabolites
Molecule Category Free-form
UNII POJ4UOY01H
EPA CompTox DTXSID6024628

Structure

InChI Key ULUZGMIUTMRARO-UHFFFAOYSA-N
Smiles NC(=O)NNC(=O)N
InChI
InChI=1S/C2H6N4O2/c3-1(7)5-6-2(4)8/h(H3,3,5,7)(H3,4,6,8)

Physicochemical Descriptors

Property Name Value
Molecular Formula C2H6N4O2
Molecular Weight 118.05
AlogP -0.93
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 6.0
Polar Surface Area 112.22
Heavy Atoms 8.0

Cross References

Resources Reference
CAS NUMBER 110-21-4
NORMAN SUSDAT
FDA SRS POJ4UOY01H
PubChem 8039
ChemSpider 7748.0