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• Synonyms (0)
• Vendors (0)
• Annotations (1)
• Representations (1)
• Notes (0)
• Targets (0)
• Clustered (0)
• Reactome (0)
• Rings (0)
• Analogs (4)

ZINC03553955

• 3553955

Physical Representations

Activity (Go SEA)

• 4500587
  

  Analogs

  9572824

  

  9815049

  

  9817830

  

  3553955

  

  4500555

  

  Popular Name: N-benzo[1,3]dioxol-5-yl-2-[[5-methyl-4-(m-tolyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide N-benzo[1,3]dioxol-5-yl-2-[[5-me…

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  Vendors

  • PubChem

    • 7257213

  Draw Identity 99% 90% 80% 70%

  Physical Representations

  Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	3.07	0.23	-14.38	1	7	0	78	382.445	5	↓ MOL2 SDF SMILES Flexibase

  More about ZINC04500587
• 20427178
  

  Analogs

  39757134

  

  3553955

  

  6334964

  

  Popular Name: N-(1,3-benzodioxol-5-yl)-2-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide N-(1,3-benzodioxol-5-yl)-2-[(5-e…

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  Vendors

  • Scientific Exchange (make on demand)

    • F-135379

  • PubChem

    • 17137193

  Draw Identity 99% 90% 80% 70%

  Physical Representations

  Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	3.01	9.31	-16.01	1	7	0	78	382.445	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC20427178
• 3424749
  

  Analogs

  3553955

  

  Popular Name: N-(1,3-benzodioxol-5-yl)-2-[[5-methyl-4-(o-tolyl)-1,2,4-triazol-3-yl]thio]acetamide N-(1,3-benzodioxol-5-yl)-2-[[5-m…

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  Vendors

  • PubChem

    • 2544069

  Draw Identity 99% 90% 80% 70%

  Physical Representations

  Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	3.05	9.59	-14.3	1	7	0	78	382.445	5	↓ MOL2 SDF SMILES Flexibase

  More about ZINC03424749
• 3409945
  

  Analogs

  3553955

  

  6334964

  

  Popular Name: N-(3,4-dimethoxyphenyl)-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]acetamide N-(3,4-dimethoxyphenyl)-2-[(5-me…

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  Vendors

  • eMolecules

    • 3657739

  • Molport

    • MolPort-004-151-263

  • Enamine

    • Z24159502

  • Mcule

    • MCULE-9058512163

  • PubChem

    • 2528854

  And 2 More

  Draw Identity 99% 90% 80% 70%

  Physical Representations

  Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Ų)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
  Ref Reference (pH 7)	2.19	9.35	-17.55	1	7	0	78	384.461	7	↓ MOL2 SDF SMILES Flexibase

  More about ZINC03409945