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• Synonyms (0)
• Vendors (0)
• Annotations (2)
• Representations (1)
• Notes (0)
• Targets (0)
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• Analogs (2)

ZINC01617594

• 1617594

Physical Representations

Activity (Go SEA)

• 34420369
  

  Analogs

  1617594

  

  1617597

  

  5601069

  

  Popular Name: 5,8-dihydroxy-2-[(1R)-1-hydroxy-4-methyl-pentyl]naphthalene-1,4-dione 5,8-dihydroxy-2-[(1R)-1-hydroxy-…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • IBM Patent Data

    • 135830376

  • PubChem

    • 10732230

  • SureChEMBL

    • SCHEMBL8851708

  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)	2.17	3.65	-8.74	3	5	0	95	290.315	4	↓ MOL2 SDF SMILES Flexibase

  More about ZINC34420369
• 34583707
  

  Analogs

  26467834

  

  1633831

  

  Popular Name: 1,4-Naphthalenedione, 5-hydroxy-3-(hydroxymethyl)-2-methyl- (9CI) 1,4-Naphthalenedione, 5-hydroxy-…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Chemstep

    • 55503

  • PubChem

    • 11481367

  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)	1.04	1.48	-11.09	2	4	0	75	218.208	1	↓ MOL2 SDF SMILES Flexibase

  More about ZINC34583707