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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL1161632
CHEMBL1161632
Compound Name BICARBONATE
ChEMBL Synonyms Bicarbonate | Carbonic Acid Anion | Hydrogen Carbonate | Bicarbonate Ion
Max Phase 0
Trade Names
Molecular Formula CH2O3

Additional synonyms for CHEMBL1161632 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES OC(=O)O
Standard InChI InChI=1S/CH2O3/c2-1(3)4/h(H2,2,3,4)
Standard InChI Key BVKZGUZCCUSVTD-UHFFFAOYSA-N

Sources

  • Scientific Literature
  • TP-search Transporter Database

Alternate Forms of Compound in ChEMBL


CHEMBL1161632

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
62 62.0004 0.21 0 57.53 ACID


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
3 2 0 3 2 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
4.36 - -.82 -3.79 0 4 0.42

Structural Alerts

There are 1 structural alerts for CHEMBL1161632. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:BVKZGUZCCUSVTD-UHFFFAOYSA-N
Wikipedia Carbonic_acid

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL1161632



ACToR 463-79-6
Brenda 2657
ChEBI 28976
eMolecules 730231
EPA CompTox Dashboard DTXSID9043801
Human Metabolome Database HMDB03538
KEGG Ligand C01353
Mcule MCULE-3743781291
Metabolights MTBLC28976
Nikkaji J148.096K
PubChem 767 3614646 22639876
PubChem: Thomson Pharma 15437053
SureChEMBL SCHEMBL1179
ZINC ZINC000006827693

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