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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL1697838
CHEMBL1697838
Compound Name GLYMIDINE
ChEMBL Synonyms GLYMIDINE SODIUM | SH 717 | GLYMIDINE
Max Phase 4 (Approved)
Trade Names
Molecular Formula C13H15N3O4S

Additional synonyms for CHEMBL1697838 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES COCCOc1cnc(NS(=O)(=O)c2ccccc2)nc1
Standard InChI InChI=1S/C13H15N3O4S/c1-19-7-8-20-11-9-14-13(15-10-11)16-21( ...
Download InChI
Standard InChI Key QFWPJPIVLCBXFJ-UHFFFAOYSA-N

Sources

  • British National Formulary
  • Scientific Literature
  • USP Dictionary of USAN and International Drug Names
  • WHO Anatomical Therapeutic Chemical Classification

Alternate Forms of Compound in ChEMBL


CHEMBL1697838

Molecule Features

CHEMBL1697838 compound icon
Drug Type:Synthetic Small Molecule Rule of Five:Y First In Class:N Chirality:Achiral Molecule Prodrug:N Oral:N Parenteral:N Topical:N Black Box:N Availability Type:Unknown

Clinical Data

ClinicalTrials.gov GLYMIDINE
The Cochrane Collaboration GLYMIDINE

Compound Bioactivity Summary

Compound Assay Summary

Compound Target Summary

Target Predictions

The two tables below display ChEMBL single-protein targets which are predicted to interact with CHEMBL1697838. A 1uM and 10 uM cut-off have been applied to ChEMBL bioactivity data used to generate the respective models and the yellow coloured rows correspond to genuine predictions, i.e. targets not included in the original training set for this compound.


10uM


ChEMBL_ID Target Name Organism Score
CHEMBL3371 Serotonin 6 (5-HT6) receptor Homo sapiens 0.211

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
309.3 309.0783 0.91 7 98.79 ACID


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
6 1 0 7 1 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
5.66 - -.07 -1.62 2 21 0.76

Structural Alerts

There are 2 structural alerts for CHEMBL1697838. To view alerts please click here.

Compound Cross References

ATC A - ALIMENTARY TRACT AND METABOLISM
A10 - DRUGS USED IN DIABETES
A10B - BLOOD GLUCOSE LOWERING DRUGS, EXCL. INSULINS
A10BC - Sulfonamides (heterocyclic)
A10BC01 - glymidine

ChemSpider ChemSpider:QFWPJPIVLCBXFJ-UHFFFAOYSA-N
Wikipedia Glymidine_sodium

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL1697838



ACToR 339-44-6
ChEBI 31660
DrugBank DB01382
DrugCentral 1321
EPA CompTox Dashboard DTXSID1023108
FDA SRS 4C5I4BQZ8F
Human Metabolome Database HMDB0015461
IBM Patent System B8AB51E4AD2AB984B853DD1E5C967623
Nikkaji J9.361K
PharmGKB PA164748839
PubChem 9565
PubChem: Thomson Pharma 16827979
SureChEMBL SCHEMBL34389
ZINC ZINC000002040778

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