Structure

InChI Key XSQUKJJJFZCRTK-UHFFFAOYSA-N
Smiles NC(N)=O
InChI
InChI=1S/CH4N2O/c2-1(3)4/h(H4,2,3,4)

Physicochemical Descriptors

Property Name Value
Molecular Formula CH4N2O
Molecular Weight 60.06
AlogP -0.98
Hydrogen Bond Acceptor 1.0
Hydrogen Bond Donor 2.0
Polar Surface Area 69.11
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 4.0

Pharmacology

EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Cricetulus griseus
- - - - 87.46-105.91

Cross References

Resources Reference
ChEBI 16199
ChEMBL CHEMBL985
DrugBank DB03904
DrugCentral 4264
FDA SRS 8W8T17847W
Human Metabolome Database HMDB0000294
Guide to Pharmacology 4539
KEGG C00086
PDB URE
PharmGKB PA451831
PubChem 1176
SureChEMBL SCHEMBL4441
ZINC ZINC000008214514