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

ZINC53127126

• 53127126

Physical Representations

Activity (Go SEA)

• 55090272
  

  Analogs

  53127126

  

  53127128

  

  Popular Name: [(1R,2S)-2-aminocyclohexyl]-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]methanone [(1R,2S)-2-aminocyclohexyl]-[(2R…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 62776702

  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)	0.07	0.82	-43.97	4	4	1	68	227.328	2	↓ MOL2 SDF SMILES Flexibase

  More about ZINC55090272
• 55090274
  

  Analogs

  53127126

  

  53127128

  

  Popular Name: [(1R,2R)-2-aminocyclohexyl]-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]methanone [(1R,2R)-2-aminocyclohexyl]-[(2R…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 62776702

  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)	0.07	0.84	-38.88	4	4	1	68	227.328	2	↓ MOL2 SDF SMILES Flexibase

  More about ZINC55090274
• 55090275
  

  Analogs

  53127126

  

  53127128

  

  Popular Name: [(1S,2S)-2-aminocyclohexyl]-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]methanone [(1S,2S)-2-aminocyclohexyl]-[(2R…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 62776702

  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)	0.07	0.86	-36.64	4	4	1	68	227.328	2	↓ MOL2 SDF SMILES Flexibase

  More about ZINC55090275
• 55090277
  

  Analogs

  53127126

  

  53127128

  

  Popular Name: [(1S,2R)-2-aminocyclohexyl]-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]methanone [(1S,2R)-2-aminocyclohexyl]-[(2R…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 62776702

  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)	0.07	0.76	-39.13	4	4	1	68	227.328	2	↓ MOL2 SDF SMILES Flexibase

  More about ZINC55090277
• 35215352
  

  Analogs

  53127126

  

  53127128

  

  53127227

  

  53127229

  

  53127230

  

  Popular Name: 3-cyclohexyl-1-[(2S)-2-(hydroxymethyl)-1-piperidyl]propan-1-one 3-cyclohexyl-1-[(2S)-2-(hydroxym…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 43421552

  • Enamine BB Make on Demand

    • BBV-25155640

  • UORSY BB Make-on-demand

    • BBV-25155640

  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)	2.94	7.08	-6.12	1	3	0	41	253.386	4	↓ MOL2 SDF SMILES Flexibase

  More about ZINC35215352
• 35215350
  

  Analogs

  53127126

  

  53127128

  

  53127227

  

  53127229

  

  53127230

  

  Popular Name: 3-cyclohexyl-1-[(2R)-2-(hydroxymethyl)-1-piperidyl]propan-1-one 3-cyclohexyl-1-[(2R)-2-(hydroxym…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 43421552

  • Enamine BB Make on Demand

    • BBV-25155640

  • UORSY BB Make-on-demand

    • BBV-25155640

  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)	2.94	7.15	-6.34	1	3	0	41	253.386	4	↓ MOL2 SDF SMILES Flexibase

  More about ZINC35215350
• 35215496
  

  Analogs

  37860736

  

  37860737

  

  53127126

  

  53127128

  

  53127309

  

  Popular Name: 3-cyclopentyl-1-[(2R)-2-(hydroxymethyl)-1-piperidyl]propan-1-one 3-cyclopentyl-1-[(2R)-2-(hydroxy…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 43421594

  • Enamine BB Make on Demand

    • BBV-25155684

  • UORSY BB Make-on-demand

    • BBV-25155684

  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)	2.25	6.58	-6.42	1	3	0	41	239.359	4	↓ MOL2 SDF SMILES Flexibase

  More about ZINC35215496