User Information

• Synonyms (0)
• Vendors (4)
• Annotations (2)
• Representations (1)
• Notes (0)
• Targets (0)
• Clustered (0)
• Reactome (0)
• Rings (0)
• Analogs (4)

ZINC00238496

• 238496

Physical Representations

Activity (Go SEA)

• 33757330
  

  Analogs

  238495

  

  Popular Name: [(1R)-1-methylpropyl] [(1R)-1-methylpropyl]

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Innovapharm Make-on-Demand

    • VT-00008741

  • ChemDB

    • 7010301

  • PubChem

    • 5158322

  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)	5.18	10.27	-8.42	0	3	0	36	284.355	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC33757330
• 33757331
  

  Analogs

  238495

  

  Popular Name: [(1S)-1-methylpropyl] [(1S)-1-methylpropyl]

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Innovapharm Make-on-Demand

    • VT-00008741

  • ChemDB

    • 7010301

  • PubChem

    • 5158322

  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)	5.18	10.27	-8.42	0	3	0	36	284.355	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC33757331
• 33757332
  

  Analogs

  238495

  

  Popular Name: [(1R)-1,2-dimethylpropyl] [(1R)-1,2-dimethylpropyl]

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Innovapharm Make-on-Demand

    • VT-00008742

  • ChemDB

    • 7010302

  • PubChem

    • 5158323

  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)	5.42	10.76	-8.59	0	3	0	36	298.382	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC33757332
• 33757333
  

  Analogs

  238495

  

  Popular Name: [(1S)-1,2-dimethylpropyl] [(1S)-1,2-dimethylpropyl]

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Innovapharm Make-on-Demand

    • VT-00008742

  • ChemDB

    • 7010302

  • PubChem

    • 5158323

  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)	5.42	10.76	-8.62	0	3	0	36	298.382	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC33757333