User Information

• Synonyms (0)
• Vendors (0)
• Annotations (2)
• Representations (2)
• Notes (0)
• Targets (0)
• Clustered (0)
• Reactome (0)
• Rings (0)
• Analogs (5)

ZINC34841084

• 34841084

Physical Representations

Activity (Go SEA)

• 40937604
  

  Analogs

  34841072

  

  34841074

  

  Popular Name: 1-(3-pyridyloxymethyl)-2-azabicyclo[2.1.1]hexane 1-(3-pyridyloxymethyl)-2-azabicy…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChEMBL12

    • CHEMBL483191

  • ChEMBL19

    • CHEMBL483191

  • PubChem

    • 25140061

  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)	1.40	3.55	-36.1	2	3	1	39	191.254	3	↓ MOL2 SDF SMILES Flexibase

  More about ZINC40937604
• 29126865
  

  Analogs

  34841080

  

  34841082

  

  34841084

  

  34841085

  

  Popular Name: 3-[(1-pyrrolidin-1-ylcyclopropyl)methoxy]pyridine 3-[(1-pyrrolidin-1-ylcyclopropyl…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • BindingDB.org

    • 86913

  • ChEMBL12

    • CHEMBL257439

  • ChEMBL12 10uM

    • CHEMBL257439

  • ChEMBL19

    • CHEMBL257439

  • PubChem

    • 69680091

  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)	1.79	6.67	-34.87	1	3	1	27	219.308	4	↓ MOL2 SDF SMILES Flexibase
  Lo Low (pH 4.5-6)	1.79	7.1	-85.17	2	3	2	28	220.316	4	↓ MOL2 SDF SMILES Flexibase

  More about ZINC29126865
• 29126913
  

  Analogs

  34841072

  

  34841074

  

  34841076

  

  34841078

  

  34841080

  

  Popular Name: N-Ethyl-1-((pyridin-3-yloxy)methyl)cyclopropanamine N-Ethyl-1-((pyridin-3-yloxy)meth…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Ark Pharm Building Blocks

    • AK146440

  • BindingDB.org

    • 86910

  • ChEMBL12

    • CHEMBL403101

  • ChEMBL12 10uM

    • CHEMBL403101

  • ChEMBL19

    • CHEMBL403101

  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)	1.52	4.51	-36.8	2	3	1	39	193.27	5	↓ MOL2 SDF SMILES Flexibase
  Lo Low (pH 4.5-6)	1.52	4.93	-85.92	3	3	2	40	194.278	5	↓ MOL2 SDF SMILES Flexibase

  More about ZINC29126913
• 3805141
  

  Analogs

  34841080

  

  34841082

  

  34841084

  

  34841085

  

  Popular Name: 3-[(1-methylpyrrolidin-2-yl)methoxy]pyridine 3-[(1-methylpyrrolidin-2-yl)meth…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Chembo Pharma

    • KB-270516

  • BindingDB.org

    • 50171348
    • 50049756

  • ChEMBL12

    • CHEMBL189064
    • CHEMBL84149

  And 13 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)	1.34	0.08	-37.62	1	3	1	26	193.27	3	↓ MOL2 SDF SMILES Flexibase

  More about ZINC03805141
• 4632524
  

  Analogs

  34841080

  

  34841082

  

  34841084

  

  34841085

  

  Popular Name: 3-[(1-methylpyrrolidin-2-yl)methoxy]pyridine 3-[(1-methylpyrrolidin-2-yl)meth…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • BindingDB.org

    • 50171348
    • 50049758

  • ChEMBL12

    • CHEMBL354602
    • CHEMBL189064

  • ChEMBL12 10uM

    • CHEMBL189064

  And 12 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)	1.34	0.66	-34.4	1	3	1	26	193.27	3	↓ MOL2 SDF SMILES Flexibase

  More about ZINC04632524