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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL3184935
CHEMBL3184935
Compound Name
ChEMBL Synonyms
Max Phase 0
Trade Names
Molecular Formula C2H4S

Additional synonyms for CHEMBL3184935 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES C1CS1
Standard InChI InChI=1S/C2H4S/c1-2-3-1/h1-2H2
Standard InChI Key VOVUARRWDCVURC-UHFFFAOYSA-N

Sources

  • PubChem BioAssays

Alternate Forms of Compound in ChEMBL


CHEMBL3184935

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
60.1 60.0034 0.73 0 0 -


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


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- - .56 .56 0 3 0.37

Structural Alerts

There are 8 structural alerts for CHEMBL3184935. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:VOVUARRWDCVURC-UHFFFAOYSA-N
PubChem SID: 144210115

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL3184935



ACToR 420-12-2
Brenda 106045
ChEBI 30977
eMolecules 475741
EPA CompTox Dashboard DTXSID3049411
FDA SRS A2W5165740
KEGG Ligand C19419
MolPort MolPort-001-782-825
Nikkaji J2.585B
NMRShiftDB 10016037
PubChem 9865
PubChem: Thomson Pharma 15296866
SureChEMBL SCHEMBL27530

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