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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL1537
CHEMBL1537
Compound Name AZLOCILLIN
ChEMBL Synonyms AZLIN | SECUROPEN | AZLOCILLIN SODIUM | Azlin | AZLOCILLIN
Max Phase 4 (Approved)
Trade Names AZLIN | SECUROPEN | Azlin
Molecular Formula C20H23N5O6S

Additional synonyms for CHEMBL1537 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](NC(=O)N3CCNC3=O)c4ccccc4)C(= ...
Download SMILES
Standard InChI InChI=1S/C20H23N5O6S/c1-20(2)13(17(28)29)25-15(27)12(16(25)3 ...
Download InChI
Standard InChI Key JTWOMNBEOCYFNV-NFFDBFGFSA-N

Sources

  • AstraZeneca Deposited Data
  • British National Formulary
  • DrugMatrix
  • Orange Book
  • Scientific Literature
  • USP Dictionary of USAN and International Drug Names
  • WHO Anatomical Therapeutic Chemical Classification

Alternate Forms of Compound in ChEMBL


CHEMBL1537

Molecule Features

CHEMBL1537 compound icon
Drug Type:Natural Product-derived Rule of Five:Y First In Class:N Chirality:Single Stereoisomer Prodrug:N Oral:N Parenteral:Y Topical:N Black Box:N Availability Type:Discontinued

Mechanism of Action

Mechanism of Action ChEMBL Target References
Penicillin-binding protein inhibitor Penicillin-binding protein PubMed

Clinical Data

ClinicalTrials.gov AZLOCILLIN
The Cochrane Collaboration AZLOCILLIN

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
461.5 461.1369 0.09 5 148.15 ACID


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
6 4 0 11 4 1


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
2.44 - .83 -2.9 1 32 0.45

Structural Alerts

There are 5 structural alerts for CHEMBL1537. To view alerts please click here.

Compound Cross References

ATC J - ANTIINFECTIVES FOR SYSTEMIC USE
J01 - ANTIBACTERIALS FOR SYSTEMIC USE
J01C - BETA-LACTAM ANTIBACTERIALS, PENICILLINS
J01CA - Penicillins with extended spectrum
J01CA09 - azlocillin

ChemSpider ChemSpider:JTWOMNBEOCYFNV-NFFDBFGFSA-N
Wikipedia Azlocillin

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL1537



ChEBI 2956
DrugBank DB01061
DrugCentral 277
FDA SRS HUM6H389W0
Human Metabolome Database HMDB0015194
IBM Patent System 13F2272F6BCE34E0A834415D3AF98693
LINCS LSM-15179
Mcule MCULE-2342058265
MolPort MolPort-023-314-370
Nikkaji J19.344E
PubChem 6479523
PubChem: Thomson Pharma 16839133
SureChEMBL SCHEMBL34150
ZINC ZINC000003830261

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