User Information

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

ZINC44211891

• 44211891

Physical Representations

Activity (Go SEA)

• 1602684
  

  Analogs

  4429861

  

  21805746

  

  21805749

  

  34675236

  

  34675237

  

  Popular Name: (2R)-2-[(3-methylphenoxy)methyl]tetrahydrofuran (2R)-2-[(3-methylphenoxy)methyl]…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChemDB

    • 4963276

  • PubChem

    • 57880672
    • 229662

  • Enamine BB Make on Demand

    • BBV-39186308

  • UORSY BB Make-on-demand

    • BBV-39186308

  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)	2.79	5.85	-6.15	0	2	0	18	192.258	3	↓ MOL2 SDF SMILES Flexibase

  More about ZINC01602684
• 4429861
  

  Analogs

  21805746

  

  21805749

  

  34675236

  

  34675237

  

  44198205

  

  Popular Name: 2-[(3-methylphenoxy)methyl]tetrahydrofuran 2-[(3-methylphenoxy)methyl]tetra…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChemDB

    • 4963276

  • PubChem

    • 68386666
    • 57880672
    • 229662

  • Enamine BB Make on Demand

    • BBV-39186308

  And 1 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)	2.79	0.07	-5.87	0	2	0	18	192.258	3	↓ MOL2 SDF SMILES Flexibase

  More about ZINC04429861
• 3106146
  

  Analogs

  32007457

  

  32007459

  

  32008558

  

  32008846

  

  32008997

  

  Popular Name: 1-methyl-3-[6-(3-methylphenoxy)hexoxy]benzene 1-methyl-3-[6-(3-methylphenoxy)h…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • eMolecules

    • 2351519

  • Mcule

    • MCULE-6519191925

  • ChemDB

    • 4286107

  • Collaborative Drug Discovery

    • 664394

  • PubChem

    • 2304788

  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)	6.08	2.16	-6.11	0	2	0	18	298.426	9	↓ MOL2 SDF SMILES Flexibase

  More about ZINC03106146