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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL2106111
CHEMBL2106111
Compound Name CALCIUM LACTATE
ChEMBL Synonyms PREQUIST POWDER | CALCIUM LACTATE
Max Phase 1
Trade Names
Molecular Formula C6H10CaO6

Additional synonyms for CHEMBL2106111 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES [Ca+2].CC(O)C(=O)[O-].CC(O)C(=O)[O-]
Standard InChI InChI=1S/2C3H6O3.Ca/c2*1-2(4)3(5)6;/h2*2,4H,1H3,(H,5,6);/q;; ...
Download InChI
Standard InChI Key MKJXYGKVIBWPFZ-UHFFFAOYSA-L

Alternate Forms of Compound in ChEMBL


CHEMBL2106111

Molecule Features

CHEMBL2106111 compound icon
Drug Type:Synthetic Small Molecule Rule of Five:N First In Class:N Chirality:Unknown Prodrug:N Oral:Unclassified Parenteral:Unclassified Topical:Unclassified Black Box:Unclassified Availability Type:Unclassified

Clinical Data

Number of clinical trials registered at clinicaltrials.gov
Number of reviews at The Cochrane Collaboration
Number of entries at British National Formulary

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
- - - - - -


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
- - - - - -


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

Structural Alerts

There are no structural alerts for CHEMBL2106111

Compound Cross References

ATC A - ALIMENTARY TRACT AND METABOLISM
A12 - MINERAL SUPPLEMENTS
A12A - CALCIUM
A12AA - Calcium
A12AA05 - calcium lactate

ChemSpider ChemSpider:MKJXYGKVIBWPFZ-UHFFFAOYSA-L
PubChem SID: 144208576 SID: 144213213

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL2106111



ACToR 5743-48-6 814-80-2 145179-24-4
eMolecules 901499
EPA CompTox Dashboard DTXSID0020236
Nikkaji J2.113J
PubChem 521805 13144
SureChEMBL SCHEMBL4319

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