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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL1240977
CHEMBL1240977
Compound Name OXANTEL
ChEMBL Synonyms Oxantel
Max Phase 0
Trade Names
Molecular Formula C13H16N2O

Additional synonyms for CHEMBL1240977 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES CN1CCCN=C1\C=C\c2cccc(O)c2
Standard InChI InChI=1S/C13H16N2O/c1-15-9-3-8-14-13(15)7-6-11-4-2-5-12(16)1 ...
Download InChI
Standard InChI Key VRYKTHBAWRESFI-VOTSOKGWSA-N

Structural Alerts

There are 1 structural alerts for CHEMBL1240977. To view alerts please click here.

Alternate Forms of Compound in ChEMBL


CHEMBL1240977

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
216.3 216.1263 1.61 2 35.83 BASE


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


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
9.42 13.17 1.87 -.14 1 16 0.82

Compound Cross References

ChemSpider ChemSpider:VRYKTHBAWRESFI-VOTSOKGWSA-N

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL1240977



ACToR 36531-26-7
eMolecules 25691735
FDA SRS 94AJJ30D9E
MolPort MolPort-005-934-007
Nikkaji J17.731H
PubChem 5281087
PubChem: Thomson Pharma 14749002
SureChEMBL SCHEMBL43905

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