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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL403308
CHEMBL403308
Compound Name
ChEMBL Synonyms SRT-2183
Max Phase 0
Trade Names
Molecular Formula C27H24N4O2S

Additional synonyms for CHEMBL403308 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES O[C@@H]1CCN(Cc2csc3nc(cn23)c4ccccc4NC(=O)c5ccc6ccccc6c5)C1
Standard InChI InChI=1S/C27H24N4O2S/c32-22-11-12-30(15-22)14-21-17-34-27-29 ...
Download InChI
Standard InChI Key MUFSINOSQBMSLE-JOCHJYFZSA-N

Sources

  • Scientific Literature

Alternate Forms of Compound in ChEMBL


CHEMBL403308

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
468.6 468.162 3.6 5 98.11 BASE


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
4 2 0 6 2 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
12.91 8.62 3.75 2.26 5 34 0.41

Structural Alerts

There are no structural alerts for CHEMBL403308

Compound Cross References

ChemSpider ChemSpider:MUFSINOSQBMSLE-JOCHJYFZSA-N
Wikipedia SRT2183

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL403308



BindingDB 50376978
IBM Patent System 3221EEBAB3685AD73ED29981D5E5D408
Nikkaji J2.529.817I
PubChem 24180126
PubChem: Thomson Pharma 48412537
SureChEMBL SCHEMBL1325303
ZINC ZINC000029043608

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