User Information

• Synonyms (0)
• Vendors (2)
• Annotations (1)
• Representations (1)
• Notes (0)
• Targets (0)
• Clustered (0)
• Reactome (0)
• Rings (3)
• Analogs (7)

ZINC41651134

• 41651134

Physical Representations

Activity (Go SEA)

• 44790017
  

  Analogs

  41651128

  

  41651134

  

  Popular Name: 3-methyl-N-(1-methylsulfonyl-4-piperidyl)benzenesulfonamide 3-methyl-N-(1-methylsulfonyl-4-p…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Otava (Virtual)

    • 4514512

  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)	1.23	1.06	-16.95	1	6	0	84	332.447	4	↓ MOL2 SDF SMILES Flexibase

  More about ZINC44790017
• 48666246
  

  Analogs

  41651128

  

  41651134

  

  Popular Name: N,N-dimethyl-1-(m-tolylsulfonyl)piperidin-4-amine N,N-dimethyl-1-(m-tolylsulfonyl)…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Otava (Virtual)

    • 5783435

  • PubChem

    • 47317977

  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)	2.10	6.17	-42.72	1	4	1	42	283.417	3	↓ MOL2 SDF SMILES Flexibase

  More about ZINC48666246
• 49404371
  

  Analogs

  41651134

  

  41664396

  

  Popular Name: 3-methyl-N-[2-[(2R)-1-(p-tolylsulfonyl)-2-piperidyl]ethyl]benzenesulfonamide 3-methyl-N-[2-[(2R)-1-(p-tolylsu…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 49713744

  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)	3.98	6.31	-16.47	1	6	0	84	436.599	7	↓ MOL2 SDF SMILES Flexibase

  More about ZINC49404371
• 49404374
  

  Analogs

  41651134

  

  41664396

  

  Popular Name: 3-methyl-N-[2-[(2S)-1-(p-tolylsulfonyl)-2-piperidyl]ethyl]benzenesulfonamide 3-methyl-N-[2-[(2S)-1-(p-tolylsu…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 49713744

  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)	3.98	6.2	-15.77	1	6	0	84	436.599	7	↓ MOL2 SDF SMILES Flexibase

  More about ZINC49404374
• 6509264
  

  Analogs

  34955773

  

  36731549

  

  36731610

  

  37053184

  

  37055569

  

  Popular Name: N,2,5-trimethyl-N-(1-methyl-4-piperidyl)-benzenesulfonamide N,2,5-trimethyl-N-(1-methyl-4-pi…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Enamine-REAL

    • Z45509828

  • Otava (Virtual)

    • 9998730

  • ChemDB

    • 7247169

  • PubChem

    • 4963939
    • 7987086

  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)	2.50	-2	-44.45	1	4	1	41	297.444	3	↓ MOL2 SDF SMILES Flexibase

  More about ZINC06509264
• 29455320
  

  Analogs

  33713452

  

  33713453

  

  37116489

  

  41651128

  

  41651134

  

  Popular Name: 3-cyano-N-(1-ethyl-4-piperidyl)-N-methyl-benzenesulfonamide 3-cyano-N-(1-ethyl-4-piperidyl)-…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • eMolecules

    • 25663043

  • Enamine

    • Z295858152

  • Mcule

    • MCULE-1504164845

  • PubChem

    • 36649179

  • Ambinter

    • Amb9176568

  And 3 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)	1.78	6.7	-45.89	1	5	1	66	308.427	4	↓ MOL2 SDF SMILES Flexibase

  More about ZINC29455320
• 12750413
  

  Analogs

  12943142

  

  41651128

  

  41651134

  

  9883259

  

  Popular Name: 3,4-dimethyl-N-[1-(p-tolylsulfonyl)-4-piperidyl]benzenesulfonamide 3,4-dimethyl-N-[1-(p-tolylsulfon…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • eMolecules

    • 16780239

  • Molport

    • MolPort-005-662-527

  • Enamine

    • Z223341332

  • Mcule

    • MCULE-6075053316

  • PubChem

    • 17534948

  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)	3.61	5.46	-15.26	1	6	0	84	422.572	5	↓ MOL2 SDF SMILES Flexibase

  More about ZINC12750413