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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL537204
CHEMBL537204
Compound Name BENZAMIDINE HYDROCHLORIDE
ChEMBL Synonyms Benzamidine Hydrochloride
Max Phase 0
Trade Names
Molecular Formula C7H9ClN2

Additional synonyms for CHEMBL537204 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES Cl.NC(=N)c1ccccc1
Standard InChI InChI=1S/C7H8N2.ClH/c8-7(9)6-4-2-1-3-5-6;/h1-5H,(H3,8,9);1H
Standard InChI Key LZCZIHQBSCVGRD-UHFFFAOYSA-N

Sources

  • PubChem BioAssays
  • Scientific Literature

Alternate Forms of Compound in ChEMBL


CHEMBL537204

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
120.2 120.0687 0.89 1 49.87 BASE


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
1 2 0 2 3 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- 11.6 .89 -1.11 1 9 0.42

Structural Alerts

There are 5 structural alerts for CHEMBL537204. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:LZCZIHQBSCVGRD-UHFFFAOYSA-N
PubChem SID: 144212482 SID: 50105946

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL537204



ACToR 143504-23-8 1670-14-0
eMolecules 507782
EPA CompTox Dashboard DTXSID9044401
FDA SRS 0G112W4L27
Mcule MCULE-1587481203
MolPort MolPort-001-011-631
PubChem 10997293 66824376 80289 10898949
PubChem: Thomson Pharma 16056614 15946760 16899072
SureChEMBL SCHEMBL61379

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