User Information

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

ZINC39919256

• 39919256

Physical Representations

Activity (Go SEA)

• 12932167
  

  Analogs

  25148920

  

  25148923

  

  25539153

  

  25539159

  

  39919256

  

  Popular Name: (2S)-N-isopropyl-2-(2-oxo-1,3-benzoxazol-3-yl)propanamide (2S)-N-isopropyl-2-(2-oxo-1,3-be…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Mcule

    • MCULE-2553635952

  • Innovapharm Make-on-Demand

    • VT-00233093

  • Collaborative Drug Discovery

    • 1216238

  • PubChem

    • 25614964
    • 18886800

  And 2 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)	1.39	5.84	-20.24	1	5	0	64	248.282	3	↓ MOL2 SDF SMILES Flexibase

  More about ZINC12932167
• 12932162
  

  Analogs

  12932167

  

  25148920

  

  25148923

  

  25539153

  

  25539159

  

  Popular Name: (2R)-N-isopropyl-2-(2-oxo-1,3-benzoxazol-3-yl)propanamide (2R)-N-isopropyl-2-(2-oxo-1,3-be…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Mcule

    • MCULE-2553635952

  • Innovapharm Make-on-Demand

    • VT-00233093

  • Collaborative Drug Discovery

    • 1216238

  • PubChem

    • 25614961
    • 18886800

  And 2 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)	1.39	5.83	-20.49	1	5	0	64	248.282	3	↓ MOL2 SDF SMILES Flexibase

  More about ZINC12932162
• 25169705
  

  Analogs

  25539153

  

  25539159

  

  39919256

  

  39919257

  

  39919258

  

  Popular Name: 3-[(1S)-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-1-methyl-2-oxo-ethyl]-1,3-benzoxazol-2-one 3-[(1S)-2-[4-(cyclopropanecarbon…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • eMolecules

    • 24047103

  • Enamine

    • Z282415472

  • Mcule

    • MCULE-4228507918

  • Collaborative Drug Discovery

    • 1285516

  • PubChem

    • 42885817

  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)	1.04	8.42	-23.46	0	7	0	76	343.383	3	↓ MOL2 SDF SMILES Flexibase

  More about ZINC25169705
• 25169711
  

  Analogs

  25539153

  

  25539159

  

  39919256

  

  39919257

  

  39919258

  

  Popular Name: 3-[(1R)-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]-1-methyl-2-oxo-ethyl]-1,3-benzoxazol-2-one 3-[(1R)-2-[4-(cyclopropanecarbon…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • eMolecules

    • 24047103

  • Enamine

    • Z282415472

  • Mcule

    • MCULE-4228507918

  • Collaborative Drug Discovery

    • 1285516

  • PubChem

    • 42885817

  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)	1.04	8.5	-29.55	0	7	0	76	343.383	3	↓ MOL2 SDF SMILES Flexibase

  More about ZINC25169711
• 2631117
  

  Analogs

  15736474

  

  15736486

  

  31504259

  

  39919256

  

  39919257

  

  Popular Name: 3-[2-(4-acetylpiperazino)-2-keto-ethyl]-1,3-benzoxazol-2-one 3-[2-(4-acetylpiperazino)-2-keto…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • eMolecules

    • 11333682

  • Molport

    • MolPort-004-276-371

  • Enamine

    • Z31726556

  • Mcule

    • MCULE-6342583291

  • Otava (Virtual)

    • 2059783

  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)	-0.15	6.12	-21.91	0	7	0	76	303.318	2	↓ MOL2 SDF SMILES Flexibase

  More about ZINC02631117
• 12918166
  

  Analogs

  12918171

  

  39919256

  

  39919257

  

  39919258

  

  39919259

  

  Popular Name: (2S)-N,N-dimethyl-2-(2-oxo-1,3-benzoxazol-3-yl)propanamide (2S)-N,N-dimethyl-2-(2-oxo-1,3-b…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Enamine

    • Z92080823

  • Collaborative Drug Discovery

    • 1229710

  • PubChem

    • 25603409
    • 42889777

  • Ambinter

    • Amb19216478

  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)	0.52	6.04	-21.41	0	5	0	55	234.255	2	↓ MOL2 SDF SMILES Flexibase

  More about ZINC12918166
• 12918171
  

  Analogs

  25148920

  

  25148923

  

  39919256

  

  39919257

  

  39919258

  

  Popular Name: (2R)-N,N-dimethyl-2-(2-oxo-1,3-benzoxazol-3-yl)propanamide (2R)-N,N-dimethyl-2-(2-oxo-1,3-b…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Enamine

    • Z92080823

  • Collaborative Drug Discovery

    • 1229710

  • PubChem

    • 25603411
    • 42889777

  • Ambinter

    • Amb19216478

  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)	0.52	6.14	-21.78	0	5	0	55	234.255	2	↓ MOL2 SDF SMILES Flexibase

  More about ZINC12918171