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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL354010
CHEMBL354010
Compound Name NALOXAZONE
ChEMBL Synonyms Naloxazone
Max Phase 0
Trade Names
Molecular Formula C19H23N3O3

Additional synonyms for CHEMBL354010 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES N\N=C/1\CC[C@@]2(O)[C@H]3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3CC=C)c ...
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Standard InChI InChI=1S/C19H23N3O3/c1-2-8-22-9-7-18-15-11-3-4-13(23)16(15)2 ...
Download InChI
Standard InChI Key XQQRNWNMEFUSMN-YSMUJFHHSA-N

Sources

  • Scientific Literature

Alternate Forms of Compound in ChEMBL


CHEMBL354010

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
341.4 341.1739 1.02 2 91.31 NEUTRAL


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
6 3 0 6 4 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
9.17 6.72 -.35 -.5 1 25 0.42

Structural Alerts

There are 7 structural alerts for CHEMBL354010. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:XQQRNWNMEFUSMN-YSMUJFHHSA-N
Wikipedia Naloxazone

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL354010



PubChem 5486802
ZINC ZINC000027742000

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