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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL1200739
CHEMBL1200739
Compound Name SULFUR, PRECIPITATED
ChEMBL Synonyms
Max Phase 0
Trade Names
Molecular Formula H2S

Additional synonyms for CHEMBL1200739 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES S
Standard InChI InChI=1S/H2S/h1H2
Standard InChI Key RWSOTUBLDIXVET-UHFFFAOYSA-N

Sources

  • Scientific Literature

Alternate Forms of Compound in ChEMBL


CHEMBL1200739

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
34.1 33.9877 -0.21 0 31.5 NEUTRAL


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


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
7.05 - - - 0 1 0.4

Structural Alerts

There are no structural alerts for CHEMBL1200739

Compound Cross References

FRAC M - MULTI-SITE CONTACT ACTIVITY
M1 - MULTI-SITE CONTACT ACTIVITY
M1M2 - INORGANIC
M1M2A - INORGANIC
M1M2A1 - SULPHUR
ChemSpider ChemSpider:RWSOTUBLDIXVET-UHFFFAOYSA-N
Wikipedia Hydrogen_sulfide

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL1200739



ACToR 13940-21-1 12673-82-4 11144-15-3 7704-34-9 7783-06-4
Brenda 128304 318 708 911 47488
ChEBI 16136
eMolecules 481062
EPA CompTox Dashboard DTXSID4024149
FDA SRS YY9FVM7NSN
Human Metabolome Database HMDB0003276
KEGG Ligand C00283
Metabolights MTBLC16136
MolPort MolPort-001-786-695
Nikkaji J644.123H J3.759A J3.750H
PDBe H2S
PubChem 402 18779926
PubChem: Thomson Pharma 15194103 15296835
SureChEMBL SCHEMBL134

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