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• Synonyms (0)
• Vendors (8)
• Annotations (3)
• Representations (1)
• Notes (0)
• Targets (0)
• Clustered (0)
• Reactome (0)
• Rings (0)
• Analogs (2)

ZINC02932244

• 2932244

Physical Representations

Activity (Go SEA)

• 32111956
  

  Analogs

  4989982

  

  Popular Name: 1-[2-(2,4,5-trimethylphenoxy)ethyl]piperidin-4-one 1-[2-(2,4,5-trimethylphenoxy)eth…

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  Vendors

  • PubChem

    • 39361517

  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)	2.80	7.1	-6.96	0	3	0	30	261.365	4	↓ MOL2 SDF SMILES Flexibase
  Mid Mid (pH 6-8)	2.80	9.43	-45.51	1	3	1	31	262.373	4	↓ MOL2 SDF SMILES Flexibase

  More about ZINC32111956
• 32120122
  

  Analogs

  4989982

  

  Popular Name: 1-[2-(2,3,6-trimethylphenoxy)ethyl]piperidine-4-carbonitrile 1-[2-(2,3,6-trimethylphenoxy)eth…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 39371910

  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)	3.78	8.41	-7.97	0	3	0	36	272.392	4	↓ MOL2 SDF SMILES Flexibase
  Mid Mid (pH 6-8)	3.78	10.8	-48.91	1	3	1	37	273.4	4	↓ MOL2 SDF SMILES Flexibase

  More about ZINC32120122