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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL32823
CHEMBL32823
Compound Name
ChEMBL Synonyms Bis(7)-Tacrine | Bis-7-Tacrine
Max Phase 0
Trade Names
Molecular Formula C33H40N4

Additional synonyms for CHEMBL32823 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES C(CCCNc1c2CCCCc2nc3ccccc13)CCCNc4c5CCCCc5nc6ccccc46
Standard InChI InChI=1S/C33H40N4/c1(2-12-22-34-32-24-14-4-8-18-28(24)36-29- ...
Download InChI
Standard InChI Key ITZOKHKOFJOBFS-UHFFFAOYSA-N

Sources

  • Scientific Literature

Alternate Forms of Compound in ChEMBL


CHEMBL32823

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
492.7 492.3253 8.02 10 49.84 BASE


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
4 2 1 4 2 1


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- 9.4 7.83 5.29 4 37 0.22

Structural Alerts

There are 6 structural alerts for CHEMBL32823. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:ITZOKHKOFJOBFS-UHFFFAOYSA-N

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL32823



BindingDB 8963
ChEBI 138435
EPA CompTox Dashboard DTXSID10429546
Nikkaji J776.168F
PDBe AA7
PubChem 9549196
PubChem: Thomson Pharma 14761833
ZINC ZINC000001893945

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