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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL203191
CHEMBL203191
Compound Name KRESOXIM-METHYL
ChEMBL Synonyms Kresoxim-Methyl
Max Phase 0
Trade Names
Molecular Formula C18H19NO4

Additional synonyms for CHEMBL203191 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES CO\N=C(\C(=O)OC)/c1ccccc1COc2ccccc2C
Standard InChI InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15 ...
Download InChI
Standard InChI Key ZOTBXTZVPHCKPN-HTXNQAPBSA-N

Sources

  • PubChem BioAssays
  • Scientific Literature

Alternate Forms of Compound in ChEMBL


CHEMBL203191

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
313.4 313.1314 3.1 6 57.12 -


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
5 0 0 5 0 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- - 3.53 3.53 2 23 0.47

Structural Alerts

There are 9 structural alerts for CHEMBL203191. To view alerts please click here.

Compound Cross References

FRAC C - RESPIRATION
C3 - COMPLEX III: CYTOCHROME BC1 (UBIQUINOL OXIDASE) AT QO SITE (CYT B GENE)
C311 - QOI-FUNGICIDES (QUINONE OUTSIDE INHIBITORS)
C311C - OXIMINO ACETATES
C311C1 - KRESOXIM-METHYL
ChemSpider ChemSpider:ZOTBXTZVPHCKPN-HTXNQAPBSA-N
PubChem SID: 144212568 SID: 26757309

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL203191



ACToR 143390-89-0
ChEBI 2962
ChemicalBook CB6353737
eMolecules 502868
EPA CompTox Dashboard DTXSID2032558
FDA SRS 0LXZ062TTB
KEGG Ligand C11017
MolPort MolPort-003-931-379
PubChem 6112114
PubChem: Thomson Pharma 14898967
SureChEMBL SCHEMBL18664
ZINC ZINC000004652486

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