ChEMBL logo

ChEMBL

spacer
ChEMBL Statistics
  Loading Statistics...
spacer

Compound Report Card

Compound Name and Classification

Compound ID CHEMBL167667
CHEMBL167667
Compound Name ETHYL NITROSOUREA
ChEMBL Synonyms SID17389888
Max Phase 0
Trade Names
Molecular Formula C3H7N3O2

Additional synonyms for CHEMBL167667 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES CCN(N=O)C(=O)N
Standard InChI InChI=1S/C3H7N3O2/c1-2-6(5-8)3(4)7/h2H2,1H3,(H2,4,7)
Standard InChI Key FUSGACRLAFQQRL-UHFFFAOYSA-N

Clinical Trials for Compound

Number of clinical trials registered at clinicaltrials.gov

Alternate Forms of Compound in ChEMBL


CHEMBL167667

Compound Bioactivity Summary

Compound Assay Summary

Compound Target Summary

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Ro5 Violations #Rotatable Bonds Ro3 Med Chem Friendly Molecular Species
117.1 117.0538 0.01 0 2 No Yes NEUTRAL


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms Num Alerts QED Weighted
12.32 - .21 .21 0 8 2 0.41

Compound Cross References

ChemSpider ChemSpider:FUSGACRLAFQQRL-UHFFFAOYSA-N
PubChem SID: 17389888
Wikipedia ENU

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL167667



KEGG Ligand C19178
ChEBI 23995
ZINC ZINC04804054
eMolecules 592641
IBM Patent System 307386AA534535B368CAC791590E9636
Patent WO1991015578A1 WO2000054574A2 WO2000004186A1 EP0965265A2 EP0476093A1 EP0508161A1 US5387758 WO2000052210A2 WO1998022622A1 WO1999067361A1 EP0668931A1 US5780236 US5514548 EP0128018A2 EP0284419B1 EP0284419A1 EP0614989A1 WO1999001577A1 EP0128018B1 EP0476093B1 EP0508161B1 WO2000042837A1 EP0746974A2 US5638637
FDA SRS P8M1T4190R
PubChem: Thomson Pharma 15461857
PubChem 12967

UniChem REST Service Call: https://www.ebi.ac.uk/unichem/rest/verbose_inchikey/FUSGACRLAFQQRL-UHFFFAOYSA-N spacer
spacer