Synonyms
Molecule Category Free-form
UNII 2WTB3V159F
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 LELOWRISYMNNSU-UHFFFAOYSA-N
Smiles C#N
InChI
InChI=1S/CHN/c1-2/h1H

Physicochemical Descriptors

Property Name Value
Molecular Formula CHN
Molecular Weight 27.03
AlogP 0.1
Hydrogen Bond Acceptor 1.0
Polar Surface Area 23.79
Heavy Atoms 2.0

Cross References

Resources Reference
ChEMBL CHEMBL183419
FDA SRS 2WTB3V159F
PubChem 768
SureChEMBL SCHEMBL244