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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL10835
CHEMBL10835
Compound Name
ChEMBL Synonyms MMV665852 | GNF-Pf-2903
Max Phase 0
Trade Names
Molecular Formula C13H8Cl4N2O

Additional synonyms for CHEMBL10835 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES Clc1ccc(NC(=O)Nc2ccc(Cl)c(Cl)c2)cc1Cl
Standard InChI InChI=1S/C13H8Cl4N2O/c14-9-3-1-7(5-11(9)16)18-13(20)19-8-2-4 ...
Download InChI
Standard InChI Key ZDPIZPXVHVYTOK-UHFFFAOYSA-N

Sources

  • BindingDB Database
  • MMV Malaria Box
  • Novartis Malaria Screening
  • Scientific Literature
  • St Jude Leishmania Screening

Alternate Forms of Compound in ChEMBL


CHEMBL10835

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
350 347.9391 5.94 2 41.13 NEUTRAL


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


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
12.16 - 6.67 6.67 2 20 0.69

Structural Alerts

There are 1 structural alerts for CHEMBL10835. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:ZDPIZPXVHVYTOK-UHFFFAOYSA-N

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL10835



ACToR 4300-43-0
BindingDB 25729
eMolecules 931629
EPA CompTox Dashboard DTXSID20195624
FDA SRS W5A83C0L6P
IBM Patent System 75093CD73E4A3D0D241BA4BCFEEA1B57
Mcule MCULE-1409265751
MolPort MolPort-001-018-065
Nikkaji J1.468.705J
PubChem 95783
PubChem: Thomson Pharma 15496552
SureChEMBL SCHEMBL2683478
ZINC ZINC000000582127

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