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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL1200440
CHEMBL1200440
Compound Name MEPIVACAINE HYDROCHLORIDE
ChEMBL Synonyms SCANDONEST PLAIN | ARESTOCAINE HYDROCHLORIDE | POLOCAINE | CARBOCAINE | SCANDONEST | SCANDICAINE | MEPIVACAINE HYDROCHLORIDE | POLOCAINE-MPF | ISOCAINE HYDROCHLORIDE
Max Phase 4 (Approved)
Trade Names ARESTOCAINE HYDROCHLORIDE | CARBOCAINE | ISOCAINE HYDROCHLORIDE | MEPIVACAINE HYDROCHLORIDE | POLOCAINE | POLOCAINE-MPF | SCANDICAINE | SCANDONEST | SCANDONEST PLAIN
Molecular Formula C15H23ClN2O

Additional synonyms for CHEMBL1200440 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES Cl.CN1CCCCC1C(=O)Nc2c(C)cccc2C
Standard InChI InChI=1S/C15H22N2O.ClH/c1-11-7-6-8-12(2)14(11)16-15(18)13-9- ...
Download InChI
Standard InChI Key RETIMRUQNCDCQB-UHFFFAOYSA-N

Sources

  • British National Formulary
  • Orange Book
  • PubChem BioAssays
  • Scientific Literature
  • USP Dictionary of USAN and International Drug Names

Alternate Forms of Compound in ChEMBL


CHEMBL1200440

Molecule Features

CHEMBL1200440 compound icon
Drug Type:Synthetic Small Molecule Rule of Five:Y First In Class:N Chirality:Racemic Mixture Prodrug:N Oral:N Parenteral:Y Topical:N Black Box:N Availability Type:Prescription-only

Mechanism of Action

Mechanism of Action ChEMBL Target References
Sodium channel alpha subunit blocker Sodium channel alpha subunit PubMed PubMed

Clinical Data

ClinicalTrials.gov MEPIVACAINE HYDROCHLORIDE
The Cochrane Collaboration MEPIVACAINE HYDROCHLORIDE

Compound Bioactivity Summary

Compound Assay Summary

Compound Target Summary

Target Predictions

The two tables below display ChEMBL single-protein targets which are predicted to interact with CHEMBL1200440. A 1uM and 10 uM cut-off have been applied to ChEMBL bioactivity data used to generate the respective models and the yellow coloured rows correspond to genuine predictions, i.e. targets not included in the original training set for this compound.


1uM


ChEMBL_ID Target Name Organism Score
CHEMBL6141 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 0.846
CHEMBL258 Tyrosine-protein kinase LCK Homo sapiens 0.533
CHEMBL2026 Beta-lactamase AmpC Escherichia coli K-12 0.343

10uM


ChEMBL_ID Target Name Organism Score
CHEMBL6141 Acyl-CoA:cholesterol acyltransferase Oryctolagus cuniculus 0.915
CHEMBL258 Tyrosine-protein kinase LCK Homo sapiens 0.624
CHEMBL2026 Beta-lactamase AmpC Escherichia coli K-12 0.457

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
246.4 246.1732 2.73 2 32.34 NEUTRAL


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
2 1 0 3 1 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- 8.29 1.78 1.28 1 18 0.87

Structural Alerts

There are no structural alerts for CHEMBL1200440

Compound Cross References

ChemSpider ChemSpider:RETIMRUQNCDCQB-UHFFFAOYSA-N
DailyMed mepivacaine hydrochloride
PubChem SID: 144204977 SID: 26748921 SID: 56424124

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL1200440



ACToR 16452-56-5
ChEBI 6760
ChemicalBook CB6302306
eMolecules 591809
EPA CompTox Dashboard DTXSID4031566
Mcule MCULE-4459584385
MolPort MolPort-003-666-532
NIH Clinical Collection SAM001246875
PubChem 66070 517315 657372
PubChem: Thomson Pharma 14873093
Selleck mepivacaine-hydrochloride
SureChEMBL SCHEMBL34245

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