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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL351769
CHEMBL351769
Compound Name ARSANILIC ACID
ChEMBL Synonyms Arsanilic acid
Max Phase 0
Trade Names
Molecular Formula C6H8AsNO3

Additional synonyms for CHEMBL351769 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES Nc1ccc(cc1)[As](=O)(O)O
Standard InChI InChI=1S/C6H8AsNO3/c8-6-3-1-5(2-4-6)7(9,10)11/h1-4H,8H2,(H2, ...
Download InChI
Standard InChI Key XKNKHVGWJDPIRJ-UHFFFAOYSA-N

Sources

  • PubChem BioAssays
  • Scientific Literature

Alternate Forms of Compound in ChEMBL


CHEMBL351769

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

Structural Alerts

There are no structural alerts for CHEMBL351769

Compound Cross References

ChemSpider ChemSpider:XKNKHVGWJDPIRJ-UHFFFAOYSA-N
PubChem SID: 144204755 SID: 144211760 SID: 170465635 SID: 26753349 SID: 26753350 SID: 29215145 SID: 56422181 SID: 68723 SID: 8139922
Wikipedia Arsanilic_acid

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL351769



ACToR 98-50-0 125715-67-5
ChEBI 49477
DrugBank DB03006
DrugCentral 3549
eMolecules 477159
EPA CompTox Dashboard DTXSID8035138
FDA SRS UDX9AKS7GM
Mcule MCULE-2499143103
MolPort MolPort-000-928-119
Nikkaji J4.954I
PDBe ASR
PubChem 7389 6432805
PubChem: Thomson Pharma 16937278
SureChEMBL SCHEMBL160507

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