D4G

4,4'-DIPYRIDYL DISULFIDE

Created: 2005-12-15
Last modified:  2011-06-04

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Chemical Details

Formal Charge0
Atom Count22
Chiral Atom Count0
Bond Count23
Aromatic Bond Count12
2D diagram of D4G
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Chemical Component Summary

Name4,4'-DIPYRIDYL DISULFIDE
Systematic Name (OpenEye OEToolkits)4-pyridin-4-yldisulfanylpyridine
FormulaC10 H8 N2 S2
Molecular Weight220.314
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs10.04S(Sc1ccncc1)c2ccncc2
SMILESCACTVS3.341S(Sc1ccncc1)c2ccncc2
SMILESOpenEye OEToolkits1.5.0c1cnccc1SSc2ccncc2
Canonical SMILESCACTVS3.341 S(Sc1ccncc1)c2ccncc2
Canonical SMILESOpenEye OEToolkits1.5.0 c1cnccc1SSc2ccncc2
InChIInChI1.03 InChI=1S/C10H8N2S2/c1-5-11-6-2-9(1)13-14-10-3-7-12-8-4-10/h1-8H
InChIKeyInChI1.03 UHBAPGWWRFVTFS-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank IDDB07623 
Name4,4'-DIPYRIDYL DISULFIDE
Groups experimental
Synonyms4,4'-DIPYRIDYL DISULFIDE
Categories
  • Anions
  • Electrolytes
  • Hydrogen Sulfide
  • Ions
  • Sulfhydryl Reagents

Drug Targets

NameTarget SequencePharmacological ActionActions
Cytochrome P450 2A6MLASGMLLVALLVCLTVMVLMSVWQQRKSKGKLPPGPTPLPFIGNYLQLN...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 75846
ChEMBL CHEMBL1232076
ChEBI CHEBI:41814
CCDC/CSD AWUQUF, DEZJEY, DEBGUM
COD 4000461, 2233068, 4132370