User Information

• Synonyms (0)
• Vendors (2)
• Annotations (1)
• Representations (1)
• Notes (0)
• Targets (0)
• Clustered (0)
• Reactome (0)
• Rings (0)
• Analogs (7)

ZINC34658100

• 34658100

Physical Representations

Activity (Go SEA)

• 4644049
  

  Analogs

  34657151

  

  34658098

  

  34658100

  

  34961373

  

  Popular Name: 2-[4-[1-(hydroxymethyl)propylaminomethyl]phenoxy]acetamide 2-[4-[1-(hydroxymethyl)propylami…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • eMolecules

    • 2032306

  • Molport

    • MolPort-002-277-365

  • ChemBridge

    • 7905409

  • Mcule

    • MCULE-4226773601

  • Princeton BioMolecular Research

    • OSSL_990148

  And 10 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)	0.52	-4.62	-47.83	5	5	1	89	253.322	8	↓ MOL2 SDF SMILES Flexibase

  More about ZINC04644049
• 5078334
  

  Analogs

  34657151

  

  34658098

  

  34658100

  

  34961373

  

  Popular Name: 2-[4-[1-(hydroxymethyl)propylaminomethyl]phenoxy]acetamide 2-[4-[1-(hydroxymethyl)propylami…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • eMolecules

    • 2032306

  • Molport

    • MolPort-002-277-365

  • ChemBridge

    • 7905409

  • Mcule

    • MCULE-4226773601

  • Princeton BioMolecular Research

    • OSSL_990148

  And 10 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)	0.52	-4.62	-48.07	5	5	1	89	253.322	8	↓ MOL2 SDF SMILES Flexibase

  More about ZINC05078334
• 6701953
  

  Analogs

  34657045

  

  34657971

  

  34657973

  

  34658051

  

  34658069

  

  Popular Name: 2-[4-(tert-butylaminomethyl)phenoxy]acetamide 2-[4-(tert-butylaminomethyl)phen…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • eMolecules

    • 2322781

  • Molport

    • MolPort-002-127-966

  • ChemBridge

    • 9018653

  • Mcule

    • MCULE-3404443700

  • Princeton BioMolecular Research

    • OSSL_596115

  And 10 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)	1.47	3.6	-46.71	4	4	1	69	237.323	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC06701953
• 19906948
  

  Analogs

  30902899

  

  34656963

  

  34657328

  

  34657331

  

  34657819

  

  Popular Name: 2-[4-(butylaminomethyl)phenoxy]acetamide 2-[4-(butylaminomethyl)phenoxy]a…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 28445330

  • Enamine BB Make on Demand

    • BBV-125536

  • UORSY BB Make-on-demand

    • BBV-125536

  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)	1.72	4.15	-54.13	4	4	1	69	237.323	8	↓ MOL2 SDF SMILES Flexibase

  More about ZINC19906948
• 6701803
  

  Analogs

  34657155

  

  34657189

  

  34657542

  

  34657765

  

  34657767

  

  Popular Name: N-(tert-butyl)-2-{4-[(cyclopropylamino)methyl]phenoxy}acetamide N-(tert-butyl)-2-{4-[(cyclopropy…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Specs

    • AN-465/42886028

  • Vitas-M

    • STK294266

  • eMolecules

    • 6447525
    • 2537907

  • Molport

    • MolPort-000-865-300

  And 16 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)	2.21	-1.28	-46.6	3	4	1	54	277.388	7	↓ MOL2 SDF SMILES Flexibase

  More about ZINC06701803
• 5027770
  

  Analogs

  32199215

  

  34658098

  

  34658100

  

  42176375

  

  Popular Name: 2-[4-(cyclopentylaminomethyl)phenoxy]acetamide 2-[4-(cyclopentylaminomethyl)phe…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • eMolecules

    • 2319343
    • 30736077

  • Molport

    • MolPort-001-661-037
    • MolPort-009-140-836

  • ChemBridge

    • 7905815

  And 14 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)	1.68	-2.77	-50.15	4	4	1	68	249.334	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC05027770
• 4851099
  

  Analogs

  19875415

  

  34656840

  

  34657328

  

  34657331

  

  34657762

  

  Popular Name: 2-[4-(ethylaminomethyl)phenoxy]acetamide 2-[4-(ethylaminomethyl)phenoxy]a…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • eMolecules

    • 8872850
    • 2528254

  • Molport

    • MolPort-002-301-871

  • ChemBridge

    • 7998169

  • Mcule

    • MCULE-5446423329

  And 9 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)	0.66	-2.6	-49.71	4	4	1	68	209.269	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC04851099