User Information

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

ZINC40186533

• 40186533

Physical Representations

Activity (Go SEA)

• 6753129
  

  Analogs

  40180729

  

  40180730

  

  40180749

  

  40180750

  

  40180751

  

  Popular Name: N-[[1-[3-(3-methylphenoxy)propyl]benzoimidazol-2-yl]methyl]benzamide N-[[1-[3-(3-methylphenoxy)propyl…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Vitas-M

    • STK951837

  • eMolecules

    • 6264656

  • Innovapharm

    • STT-00243379

  • Mcule

    • MCULE-3521009358

  • Otava

    • 7119910787

  And 7 More

  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)	4.57	11.9	-14.39	1	5	0	56	399.494	8	↓ MOL2 SDF SMILES Flexibase

  More about ZINC06753129
• 6753130
  

  Analogs

  40180729

  

  40180730

  

  40180747

  

  40180748

  

  40180749

  

  Popular Name: N-[[1-[3-(4-methylphenoxy)propyl]benzoimidazol-2-yl]methyl]benzamide N-[[1-[3-(4-methylphenoxy)propyl…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Vitas-M

    • STK951838

  • eMolecules

    • 6264658

  • Innovapharm

    • STT-00243380

  • Mcule

    • MCULE-2633703183

  • Otava

    • 7119910788

  And 7 More

  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)	4.60	11.9	-14.23	1	5	0	56	399.494	8	↓ MOL2 SDF SMILES Flexibase

  More about ZINC06753130
• 14300555
  

  Analogs

  32888288

  

  32888289

  

  40180729

  

  40180730

  

  40180747

  

  Popular Name: N-[(1S)-1-[1-[(2S)-2-hydroxy-3-(3-methylphenoxy)propyl]benzimidazol-2-yl]ethyl]-4-methyl-benzamide N-[(1S)-1-[1-[(2S)-2-hydroxy-3-(…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • eMolecules

    • 24047487

  • Molport

    • MolPort-005-714-378

  • Enamine

    • Z370552710

  • Mcule

    • MCULE-8005753976

  • PubChem

    • 42933929

  And 3 More

  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)	4.66	10.23	-16.23	2	6	0	76	443.547	8	↓ MOL2 SDF SMILES Flexibase

  More about ZINC14300555
• 32888288
  

  Analogs

  40180729

  

  40180730

  

  40180747

  

  40180748

  

  40180749

  

  Popular Name: N-[(1R)-1-[1-[(2R)-2-hydroxy-3-(3-methylphenoxy)propyl]benzimidazol-2-yl]ethyl]-4-methyl-benzamide N-[(1R)-1-[1-[(2R)-2-hydroxy-3-(…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • eMolecules

    • 24047487

  • Molport

    • MolPort-005-714-378

  • Enamine

    • Z370552710

  • Mcule

    • MCULE-8005753976

  • PubChem

    • 42933929

  And 3 More

  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)	4.66	10.2	-13.61	2	6	0	76	443.547	8	↓ MOL2 SDF SMILES Flexibase
  Mid Mid (pH 6-8)	4.66	10.66	-39.19	3	6	1	78	444.555	8	↓ MOL2 SDF SMILES Flexibase

  More about ZINC32888288
• 32888289
  

  Analogs

  40180729

  

  40180730

  

  40180747

  

  40180748

  

  40180749

  

  Popular Name: N-[(1R)-1-[1-[(2S)-2-hydroxy-3-(3-methylphenoxy)propyl]benzimidazol-2-yl]ethyl]-4-methyl-benzamide N-[(1R)-1-[1-[(2S)-2-hydroxy-3-(…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • eMolecules

    • 24047487

  • Molport

    • MolPort-005-714-378

  • Enamine

    • Z370552710

  • Mcule

    • MCULE-8005753976

  • PubChem

    • 42933929

  And 3 More

  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)	4.66	10.18	-12.92	2	6	0	76	443.547	8	↓ MOL2 SDF SMILES Flexibase
  Mid Mid (pH 6-8)	4.66	10.65	-38.78	3	6	1	78	444.555	8	↓ MOL2 SDF SMILES Flexibase

  More about ZINC32888289
• 14300554
  

  Analogs

  14300555

  

  32888288

  

  32888289

  

  40180729

  

  40180730

  

  Popular Name: N-[(1S)-1-[1-[(2R)-2-hydroxy-3-(3-methylphenoxy)propyl]benzimidazol-2-yl]ethyl]-4-methyl-benzamide N-[(1S)-1-[1-[(2R)-2-hydroxy-3-(…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • eMolecules

    • 24047487

  • Molport

    • MolPort-005-714-378

  • Enamine

    • Z370552710

  • Mcule

    • MCULE-8005753976

  • PubChem

    • 42933929

  And 3 More

  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)	4.66	10.4	-14.77	2	6	0	76	443.547	8	↓ MOL2 SDF SMILES Flexibase

  More about ZINC14300554
• 6753127
  

  Analogs

  40180729

  

  40180730

  

  40180747

  

  40180748

  

  40180753

  

  Popular Name: N-[[1-(3-phenoxypropyl)benzoimidazol-2-yl]methyl]benzamide N-[[1-(3-phenoxypropyl)benzoimid…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Vitas-M

    • STK951835

  • eMolecules

    • 6264652

  • Innovapharm

    • STT-00243377

  • Mcule

    • MCULE-4683522430

  • Otava

    • 7119910785

  And 6 More

  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)	4.15	11.22	-14.32	1	5	0	56	385.467	8	↓ MOL2 SDF SMILES Flexibase

  More about ZINC06753127