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• Synonyms (0)
• Vendors (2)
• Annotations (1)
• Representations (1)
• Notes (0)
• Targets (0)
• Clustered (0)
• Reactome (0)
• Rings (0)
• Analogs (9)

ZINC44805731

• 44805731

Physical Representations

Activity (Go SEA)

• 52340764
  

  Analogs

  44805553

  

  44805555

  

  Popular Name: (2R)-3-amino-N-[(1S)-1-cyclohexylethyl]-2-methyl-propanamide (2R)-3-amino-N-[(1S)-1-cyclohexy…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 55211076

  • Enamine BB Make on Demand

    • BBV-43946285
    • BBV-34286031

  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)	1.59	3.26	-46.2	4	3	1	57	213.345	4	↓ MOL2 SDF SMILES Flexibase

  More about ZINC52340764
• 54337922
  

  Analogs

  44805729

  

  44805731

  

  Popular Name: (2S)-3-amino-N-[(1R)-1,4-dimethylpentyl]-2-methyl-propanamide (2S)-3-amino-N-[(1R)-1,4-dimethy…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 62669793

  • Enamine BB Make on Demand

    • BBV-38116154

  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)	1.22	3.18	-46.23	4	3	1	57	201.334	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC54337922
• 54337924
  

  Analogs

  44805729

  

  44805731

  

  Popular Name: (2S)-3-amino-N-[(1S)-1,4-dimethylpentyl]-2-methyl-propanamide (2S)-3-amino-N-[(1S)-1,4-dimethy…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 62669793

  • Enamine BB Make on Demand

    • BBV-38116154

  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)	1.22	3.18	-46.25	4	3	1	57	201.334	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC54337924
• 54337926
  

  Analogs

  44805729

  

  44805731

  

  Popular Name: (2R)-3-amino-N-[(1R)-1,4-dimethylpentyl]-2-methyl-propanamide (2R)-3-amino-N-[(1R)-1,4-dimethy…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 62669793

  • Enamine BB Make on Demand

    • BBV-38116154

  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)	1.22	3.18	-46.25	4	3	1	57	201.334	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC54337926
• 54337928
  

  Analogs

  44805729

  

  44805731

  

  Popular Name: (2R)-3-amino-N-[(1S)-1,4-dimethylpentyl]-2-methyl-propanamide (2R)-3-amino-N-[(1S)-1,4-dimethy…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 62669793

  • Enamine BB Make on Demand

    • BBV-38116154

  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)	1.22	3.18	-46.25	4	3	1	57	201.334	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC54337928
• 44805611
  

  Analogs

  44805613

  

  44805729

  

  44805731

  

  44805733

  

  44805735

  

  Popular Name: (2S)-3-amino-N-(4-ethylcyclohexyl)-2-methyl-propanamide (2S)-3-amino-N-(4-ethylcyclohexy…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 61840563

  • Enamine BB Make on Demand

    • BBV-33549876

  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)	1.33	3.71	-46.27	4	3	1	57	213.345	4	↓ MOL2 SDF SMILES Flexibase

  More about ZINC44805611
• 44805613
  

  Analogs

  44805729

  

  44805731

  

  44805733

  

  44805735

  

  44805761

  

  Popular Name: (2R)-3-amino-N-(4-ethylcyclohexyl)-2-methyl-propanamide (2R)-3-amino-N-(4-ethylcyclohexy…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 61840563

  • Enamine BB Make on Demand

    • BBV-33549876

  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)	1.33	3.71	-46.28	4	3	1	57	213.345	4	↓ MOL2 SDF SMILES Flexibase

  More about ZINC44805613
• 6309438
  

  Analogs

  6700671

  

  44805729

  

  44805731

  

  44805733

  

  44805735

  

  Popular Name: N-(1,5-dimethylhexyl)-2-ethyl-butanamide N-(1,5-dimethylhexyl)-2-ethyl-bu…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Scientific Exchange (make on demand)

    • M-130679

  • UORSY Make-on-demand

    • PB54817687

  • ChemDB

    • 6157574

  • PubChem

    • 3634957

  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)	4.30	7.97	-5.82	1	2	0	29	227.392	8	↓ MOL2 SDF SMILES Flexibase

  More about ZINC06309438
• 6309444
  

  Analogs

  6700671

  

  44805729

  

  44805731

  

  44805733

  

  44805735

  

  Popular Name: N-(1,5-dimethylhexyl)-2-ethyl-butanamide N-(1,5-dimethylhexyl)-2-ethyl-bu…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Scientific Exchange (make on demand)

    • M-130679

  • UORSY Make-on-demand

    • PB54817687

  • ChemDB

    • 6157574

  • PubChem

    • 3634957

  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)	4.30	7.96	-5.78	1	2	0	29	227.392	8	↓ MOL2 SDF SMILES Flexibase

  More about ZINC06309444