Keyword(s): Human Metabolites
Molecule Category Free-form

Structure

InChI Key NKVPNDQSRUNYEC-UHFFFAOYSA-N
Smiles CN(C)C(N)=[Se]
InChI
InChI=1S/C3H8N2Se/c1-5(2)3(4)6/h4H2,1-2H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C3H8N2Se1
Molecular Weight 151.99
AlogP -0.88
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 1.0
Polar Surface Area 29.26
Heavy Atoms 6.0

Cross References

Resources Reference
CAS NUMBER 5117-16-8
NORMAN SUSDAT