User Information

• Synonyms (0)
• Vendors (2)
• Annotations (1)
• Representations (1)
• Notes (0)
• Targets (0)
• Clustered (0)
• Reactome (0)
• Rings (0)
• Analogs (8)

ZINC37467737

• 37467737

Physical Representations

Activity (Go SEA)

• 52269250
  

  Analogs

  35136362

  

  Popular Name: 4-[[[(1S,2R)-2-methylcyclopropyl]amino]methyl]phenol 4-[[[(1S,2R)-2-methylcyclopropyl…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 62397678

  • Enamine BB Make on Demand

    • BBV-34224425

  • UORSY BB Make-on-demand

    • BBV-34224425

  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)	1.99	4.03	-38.96	3	2	1	37	178.255	3	↓ MOL2 SDF SMILES Flexibase

  More about ZINC52269250
• 52269253
  

  Analogs

  35136362

  

  Popular Name: 4-[[[(1S,2S)-2-methylcyclopropyl]amino]methyl]phenol 4-[[[(1S,2S)-2-methylcyclopropyl…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 62397678

  • Enamine BB Make on Demand

    • BBV-34224425

  • UORSY BB Make-on-demand

    • BBV-34224425

  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)	1.99	3.79	-39.57	3	2	1	37	178.255	3	↓ MOL2 SDF SMILES Flexibase

  More about ZINC52269253
• 52269256
  

  Analogs

  35136362

  

  Popular Name: 4-[[[(1R,2R)-2-methylcyclopropyl]amino]methyl]phenol 4-[[[(1R,2R)-2-methylcyclopropyl…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 62397678

  • Enamine BB Make on Demand

    • BBV-34224425

  • UORSY BB Make-on-demand

    • BBV-34224425

  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)	1.99	3.79	-39.55	3	2	1	37	178.255	3	↓ MOL2 SDF SMILES Flexibase

  More about ZINC52269256
• 52269260
  

  Analogs

  35136362

  

  Popular Name: 4-[[[(1R,2S)-2-methylcyclopropyl]amino]methyl]phenol 4-[[[(1R,2S)-2-methylcyclopropyl…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 62397678

  • Enamine BB Make on Demand

    • BBV-34224425

  • UORSY BB Make-on-demand

    • BBV-34224425

  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)	1.99	4.04	-38.93	3	2	1	37	178.255	3	↓ MOL2 SDF SMILES Flexibase

  More about ZINC52269260
• 52269373
  

  Analogs

  4218516

  

  Popular Name: (1S,2R)-N-[(4-methoxyphenyl)methyl]-2-methyl-cyclopropanamine (1S,2R)-N-[(4-methoxyphenyl)meth…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 62398276

  • Enamine BB Make on Demand

    • BBV-34224433

  • UORSY BB Make-on-demand

    • BBV-34224433

  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)	2.53	6.19	-37.98	2	2	1	26	192.282	4	↓ MOL2 SDF SMILES Flexibase

  More about ZINC52269373
• 52269378
  

  Analogs

  4218516

  

  Popular Name: (1S,2S)-N-[(4-methoxyphenyl)methyl]-2-methyl-cyclopropanamine (1S,2S)-N-[(4-methoxyphenyl)meth…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 62398276

  • Enamine BB Make on Demand

    • BBV-34224433

  • UORSY BB Make-on-demand

    • BBV-34224433

  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)	2.53	5.94	-38.6	2	2	1	26	192.282	4	↓ MOL2 SDF SMILES Flexibase

  More about ZINC52269378
• 52269381
  

  Analogs

  4218516

  

  Popular Name: (1R,2R)-N-[(4-methoxyphenyl)methyl]-2-methyl-cyclopropanamine (1R,2R)-N-[(4-methoxyphenyl)meth…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 62398276

  • Enamine BB Make on Demand

    • BBV-34224433

  • UORSY BB Make-on-demand

    • BBV-34224433

  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)	2.53	5.94	-38.57	2	2	1	26	192.282	4	↓ MOL2 SDF SMILES Flexibase

  More about ZINC52269381
• 52269384
  

  Analogs

  4218516

  

  Popular Name: (1R,2S)-N-[(4-methoxyphenyl)methyl]-2-methyl-cyclopropanamine (1R,2S)-N-[(4-methoxyphenyl)meth…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 62398276

  • Enamine BB Make on Demand

    • BBV-34224433

  • UORSY BB Make-on-demand

    • BBV-34224433

  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)	2.53	6.19	-37.97	2	2	1	26	192.282	4	↓ MOL2 SDF SMILES Flexibase

  More about ZINC52269384