DCN

DICLOSAN

Created:2001-09-13
Last modified:  2011-06-04

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Chemical Details

Formal Charge0
Atom Count24
Chiral Atom Count0
Bond Count25
Aromatic Bond Count12
2D diagram of DCN

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Chemical Component Summary

NameDICLOSAN
Systematic Name (OpenEye OEToolkits)5-chloro-2-(4-chlorophenoxy)phenol
FormulaC12 H8 Cl2 O2
Molecular Weight255.097
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04Clc2cc(O)c(Oc1ccc(Cl)cc1)cc2
SMILESCACTVS3.341Oc1cc(Cl)ccc1Oc2ccc(Cl)cc2
SMILESOpenEye OEToolkits1.5.0c1cc(ccc1Oc2ccc(cc2O)Cl)Cl
Canonical SMILESCACTVS3.341 Oc1cc(Cl)ccc1Oc2ccc(Cl)cc2
Canonical SMILESOpenEye OEToolkits1.5.0 c1cc(ccc1Oc2ccc(cc2O)Cl)Cl
InChIInChI1.03 InChI=1S/C12H8Cl2O2/c13-8-1-4-10(5-2-8)16-12-6-3-9(14)7-11(12)15/h1-7,15H
InChIKeyInChI1.03 BYNQFCJOHGOKSS-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank data are sourced from datasets licensed under a Creative Common's Attribution-NonCommercial 4.0 International License
DrugBank IDDB04393 
NameSoneclosan
Groups experimental
Synonyms
  • Soneclosan
  • Hydroxydichlorodiphenyl ether
  • 5-chloro-2-(p-chlorophenoxy)phenol
CAS number3380-30-1

Drug Targets

DrugBank data are sourced from datasets licensed under a Creative Common's Attribution-NonCommercial 4.0 International License
NameTarget SequencePharmacological ActionActions
Enoyl-[acyl-carrier-protein] reductase [NADH]MTGLLDGKRILVSGIITDSSIAFHIARVAQEQGAQLVLTGFDRLRLIQRI...unknowninhibitor
Enoyl-[acyl-carrier-protein] reductase [NADH] FabIMGFLKGKKGLIVGVANNKSIAYGIAQSCFNQGATLAFTYLNESLEKRVRP...unknown
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682

Related Resource References

Resource NameReference
PubChem 18807
ChEMBL CHEMBL1232142