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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL296854
CHEMBL296854
Compound Name PRIMAXIN
ChEMBL Synonyms
Max Phase 0
Trade Names
Molecular Formula C28H45N5O10S2

Additional synonyms for CHEMBL296854 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES O.C[C@@H](O)[C@@H]1[C@H]2CC(=C(N2C1=O)C(=O)O)SCC\N=C/N.CC3(C ...
Download SMILES
Standard InChI InChI=1S/C16H26N2O5S.C12H17N3O4S.H2O/c1-16(2)8-10(16)13(19)1 ...
Download InChI
Standard InChI Key DAYDLKPFBFPKHL-KJWPAVRRSA-N

Structural Alerts

There are no structural alerts for CHEMBL296854

Alternate Forms of Compound in ChEMBL


CHEMBL296854

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
- - - - - -


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
- - - - - -


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- - - - - - -0

Compound Cross References

ChemSpider ChemSpider:DAYDLKPFBFPKHL-KJWPAVRRSA-N
Wikipedia Imipenem/cilastatin

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL296854



PubChem 66871065
SureChEMBL SCHEMBL996256

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