User Information

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

ZINC37852294

• 37852294

Physical Representations

Activity (Go SEA)

• 33866891
  

  Analogs

  37852266

  

  37852267

  

  37852268

  

  37852269

  

  37852274

  

  Popular Name: 1-Cyclopentylamino-3-cyclopentyloxy-2-propanol fumarate; 2-Propanol, 1-cyclopentylamino-3-cyclopentyloxy-, fumarate; LS-121994 1-Cyclopentylamino-3-cyclopentyl…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Innovapharm

    • STT-00399940

  • TimTec Make-on-Demand

    • ST51161366

  • Leadscope via PubChem

    • LS-121994

  • PubChem

    • 6447194
    • 3055725

  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)	2.24	3.98	-38.54	3	3	1	46	228.356	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC33866891
• 33866892
  

  Analogs

  37852266

  

  37852267

  

  37852268

  

  37852269

  

  37852274

  

  Popular Name: 1-Cyclopentylamino-3-cyclopentyloxy-2-propanol fumarate; 2-Propanol, 1-cyclopentylamino-3-cyclopentyloxy-, fumarate; LS-121994 1-Cyclopentylamino-3-cyclopentyl…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Innovapharm

    • STT-00399940

  • TimTec Make-on-Demand

    • ST51161366

  • Leadscope via PubChem

    • LS-121994

  • PubChem

    • 6447194
    • 3055725

  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)	2.24	3.96	-38.39	3	3	1	46	228.356	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC33866892
• 20146547
  

  Analogs

  37852293

  

  37852294

  

  37852295

  

  37852296

  

  45616465

  

  Popular Name: N-[3-[[(2S)-tetrahydrofuran-2-yl]methoxy]propyl]cyclopentanamine N-[3-[[(2S)-tetrahydrofuran-2-yl…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 43182510
    • 28680306

  • Enamine BB Make on Demand

    • BBV-172764

  • UORSY BB Make-on-demand

    • BBV-172764

  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)	2.13	5.43	-39.69	2	3	1	35	228.356	7	↓ MOL2 SDF SMILES Flexibase

  More about ZINC20146547
• 20146548
  

  Analogs

  37852293

  

  37852294

  

  37852295

  

  37852296

  

  45616465

  

  Popular Name: N-[3-[[(2R)-tetrahydrofuran-2-yl]methoxy]propyl]cyclopentanamine N-[3-[[(2R)-tetrahydrofuran-2-yl…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 43182510
    • 28680308

  • Enamine BB Make on Demand

    • BBV-172764

  • UORSY BB Make-on-demand

    • BBV-172764

  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)	2.13	5.35	-39.77	2	3	1	35	228.356	7	↓ MOL2 SDF SMILES Flexibase

  More about ZINC20146548