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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL1200991
CHEMBL1200991
Compound Name CARBENICILLIN INDANYL SODIUM
ChEMBL Synonyms CARINDACILLIN SODIUM | GEOCILLIN | CP-15464-2 | CP-15,464-2 | CARBENICILLIN INDANYL SODIUM
Max Phase 4 (Approved)
Trade Names GEOCILLIN
Molecular Formula C26H25N2NaO6S

Additional synonyms for CHEMBL1200991 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES [Na+].CC1(C)S[C@@H]2[C@H](NC(=O)C(C(=O)Oc3ccc4CCCc4c3)c5cccc ...
Download SMILES
Standard InChI InChI=1S/C26H26N2O6S.Na/c1-26(2)20(24(31)32)28-22(30)19(23(2 ...
Download InChI
Standard InChI Key QFWPXOXWAUAYAB-XZVIDJSISA-M

Sources

  • Orange Book
  • Scientific Literature
  • USP Dictionary of USAN and International Drug Names

Alternate Forms of Compound in ChEMBL


CHEMBL1200991

Molecule Features

CHEMBL1200991 compound icon
Drug Type:Natural Product-derived Rule of Five:Y First In Class:N Chirality:Racemic Mixture Prodrug:Y Oral:Y Parenteral:N Topical:N Black Box:N Availability Type:Discontinued

Mechanism of Action

Mechanism of Action ChEMBL Target References
Bacterial penicillin-binding protein inhibitor Bacterial penicillin-binding protein FDA PubMed PubMed PubMed

Indications

MESH Heading MESH ID EFO ID EFO Term Max phase for indication References
OsteomyelitisD010019EFO:0003102osteomyelitis0ClinicalTrials
ClinicalTrials

Clinical Data

ClinicalTrials.gov CARBENICILLIN INDANYL SODIUM
The Cochrane Collaboration CARBENICILLIN INDANYL SODIUM

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
494.6 494.1512 2.5 6 113.01 ACID


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
6 2 0 8 2 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
2.44 - 3.58 -.14 2 35 0.27

Structural Alerts

There are 8 structural alerts for CHEMBL1200991. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:QFWPXOXWAUAYAB-XZVIDJSISA-M
Wikipedia Carindacillin

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL1200991



ACToR 26605-69-6
ChEBI 31358
KEGG Ligand C12712
Nikkaji J9.800K
PubChem 102090442 23676503
PubChem: Thomson Pharma 14884968
SureChEMBL SCHEMBL33856

UniChem REST Service Call:
https://www.ebi.ac.uk/unichem/rest/verbose_inchikey/QFWPXOXWAUAYAB-XZVIDJSISA-M spacer
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