User Information

• Synonyms (0)
• Vendors (2)
• Annotations (1)
• Representations (1)
• Notes (0)
• Targets (0)
• Clustered (0)
• Reactome (0)
• Rings (1)
• Analogs (4)

ZINC37112203

• 37112203

Physical Representations

Activity (Go SEA)

• 48441464
  

  Analogs

  36788460

  

  36789786

  

  Popular Name: N-[5-chloro-2-(1-piperidyl)phenyl]butanamide N-[5-chloro-2-(1-piperidyl)pheny…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 47100293

  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)	4.17	8.66	-6.69	1	3	0	32	280.799	4	↓ MOL2 SDF SMILES Flexibase

  More about ZINC48441464
• 31972157
  

  Analogs

  31972158

  

  31972159

  

  31972160

  

  31972163

  

  31972165

  

  Popular Name: N-(2-acetamido-5-chloro-phenyl)-4-amino-butanamide N-(2-acetamido-5-chloro-phenyl)-…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 39194052

  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)	0.29	2.01	-61.48	5	5	1	86	270.74	5	↓ MOL2 SDF SMILES Flexibase

  More about ZINC31972157
• 31972161
  

  Analogs

  31972162

  

  31972163

  

  31972165

  

  31972166

  

  31972167

  

  Popular Name: 4-amino-N-[5-chloro-2-(2-methylpropanoylamino)phenyl]butanamide 4-amino-N-[5-chloro-2-(2-methylp…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 39194060

  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)	1.37	3.5	-61.15	5	5	1	86	298.794	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC31972161
• 31972162
  

  Analogs

  31972163

  

  31972165

  

  31972166

  

  31972167

  

  31972175

  

  Popular Name: N-[2-(4-aminobutanoylamino)-4-chloro-phenyl]-2,2-dimethyl-propanamide N-[2-(4-aminobutanoylamino)-4-ch…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 39194062

  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)	1.95	4.05	-61.3	5	5	1	86	312.821	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC31972162