User Information

• Synonyms (0)
• Vendors (2)
• Annotations (1)
• Representations (1)
• Notes (0)
• Targets (0)
• Clustered (0)
• Reactome (0)
• Rings (0)
• Analogs (6)

ZINC21501857

• 21501857

Physical Representations

Activity (Go SEA)

• 42858305
  

  Analogs

  37259656

  

  37258290

  

  Popular Name: 5-amino-2-methyl-N-[[(1R,2S)-2-methylcyclohexyl]methyl]benzenesulfonamide 5-amino-2-methyl-N-[[(1R,2S)-2-m…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 61610317

  • Enamine BB Make on Demand

    • BBV-33264107

  • UORSY BB Make-on-demand

    • BBV-33264107

  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)	2.99	3.88	-9.04	3	4	0	72	296.436	4	↓ MOL2 SDF SMILES Flexibase

  More about ZINC42858305
• 42858308
  

  Analogs

  37259656

  

  37258290

  

  Popular Name: 5-amino-2-methyl-N-[[(1S,2S)-2-methylcyclohexyl]methyl]benzenesulfonamide 5-amino-2-methyl-N-[[(1S,2S)-2-m…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 61610317

  • Enamine BB Make on Demand

    • BBV-33264107

  • UORSY BB Make-on-demand

    • BBV-33264107

  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)	2.99	4.12	-8.84	3	4	0	72	296.436	4	↓ MOL2 SDF SMILES Flexibase

  More about ZINC42858308
• 42858311
  

  Analogs

  37259656

  

  37258290

  

  Popular Name: 5-amino-2-methyl-N-[[(1R,2R)-2-methylcyclohexyl]methyl]benzenesulfonamide 5-amino-2-methyl-N-[[(1R,2R)-2-m…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 61610317

  • Enamine BB Make on Demand

    • BBV-33264107

  • UORSY BB Make-on-demand

    • BBV-33264107

  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)	2.99	4.11	-9.02	3	4	0	72	296.436	4	↓ MOL2 SDF SMILES Flexibase

  More about ZINC42858311
• 42858314
  

  Analogs

  37259656

  

  37258290

  

  Popular Name: 5-amino-2-methyl-N-[[(1S,2R)-2-methylcyclohexyl]methyl]benzenesulfonamide 5-amino-2-methyl-N-[[(1S,2R)-2-m…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 61610317

  • Enamine BB Make on Demand

    • BBV-33264107

  • UORSY BB Make-on-demand

    • BBV-33264107

  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)	2.99	3.89	-8.91	3	4	0	72	296.436	4	↓ MOL2 SDF SMILES Flexibase

  More about ZINC42858314
• 44655805
  

  Analogs

  11737139

  

  21502685

  

  Popular Name: 5-amino-N-(4-methoxybutyl)-2-methyl-benzenesulfonamide 5-amino-N-(4-methoxybutyl)-2-met…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 61815954

  • Enamine BB Make on Demand

    • BBV-33521045

  • UORSY BB Make-on-demand

    • BBV-33521045

  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)	0.98	0.9	-10.83	3	5	0	81	272.37	7	↓ MOL2 SDF SMILES Flexibase

  More about ZINC44655805
• 45665244
  

  Analogs

  11737139

  

  21502685

  

  Popular Name: 5-amino-N-[4-(dimethylamino)butyl]-2-methyl-benzenesulfonamide 5-amino-N-[4-(dimethylamino)buty…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 61963218

  • Enamine BB Make on Demand

    • BBV-33661864

  • UORSY BB Make-on-demand

    • BBV-33661864

  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)	1.03	3.13	-43.54	4	5	1	77	286.421	7	↓ MOL2 SDF SMILES Flexibase

  More about ZINC45665244