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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL1916078
CHEMBL1916078
Compound Name THIAZOLIDINE
ChEMBL Synonyms Thiazolidine
Max Phase 0
Trade Names
Molecular Formula C3H7NS

Additional synonyms for CHEMBL1916078 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES C1CSCN1
Standard InChI InChI=1S/C3H7NS/c1-2-5-3-4-1/h4H,1-3H2
Standard InChI Key OGYGFUAIIOPWQD-UHFFFAOYSA-N

Sources

  • Scientific Literature

Alternate Forms of Compound in ChEMBL


CHEMBL1916078

Compound Bioactivity Summary

Compound Assay Summary

Compound Target Summary

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
89.2 89.0299 0.28 0 12.03 BASE


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
2 1 0 1 1 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- 8.84 -1.73 -3.17 0 5 0.46

Structural Alerts

There are no structural alerts for CHEMBL1916078

Compound Cross References

ChemSpider ChemSpider:OGYGFUAIIOPWQD-UHFFFAOYSA-N

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL1916078



ACToR 504-78-9
BindingDB 50357214
ChEBI 50120
ChemicalBook CB4312507
eMolecules 482510
EPA CompTox Dashboard DTXSID10198447
FDA SRS I320806BKW
Mcule MCULE-8646299838
MolPort MolPort-001-791-900
Nikkaji J149.955F
NMRShiftDB 10016051
PubChem 10444
PubChem: Thomson Pharma 14747376
SureChEMBL SCHEMBL7360
ZINC ZINC000001584141

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