Synonyms
Molecule Category Salt-form
UNII 968JJ8C9DV
EPA CompTox DTXSID8020121
Source Gaulton A, Kale N, van Westen GJ, Bellis LJ, Bento AP, Davies M, Hersey A, Papadatos G, Forster M, Wege P, Overington JP. A large-scale crop protection bioassay data set. Sci Data. 2015 Jul 7;2:150032. Read more ...

Structure

InChI Key PXIPVTKHYLBLMZ-UHFFFAOYSA-N
Smiles [Na+].[N-]=[N+]=[N-]
InChI
InChI=1S/N3.Na/c1-3-2;/q-1;+1

Physicochemical Descriptors

Property Name Value
Molecular Formula N3Na
Molecular Weight 65.01
AlogP 0.84
Hydrogen Bond Acceptor 2.0
Polar Surface Area 61.18
Heavy Atoms 3.0

Cross References

Resources Reference
CAS NUMBER 26628-22-8
ChEMBL CHEMBL89295
FDA SRS 968JJ8C9DV
PubChem 4427778
SureChEMBL SCHEMBL123