User Information

• Synonyms (2)
• Vendors (8)
• Annotations (3)
• Representations (1)
• Notes (0)
• Targets (0)
• Clustered (0)
• Reactome (0)
• Rings (0)
• Analogs (7)

ZINC08440165

• 8440165

Physical Representations

Activity (Go SEA)

• 16265428
  

  Analogs

  702404

  

  Popular Name: ethyl 5-(4-methoxyphenyl)-7-methyl-3-oxo-2-(1H-pyrrol-2-ylmethylene)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate ethyl 5-(4-methoxyphenyl)-7-meth…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Specs

    • AF-399/41752539

  • ChemBridge

    • 7392946

  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)	4.85	11.22	-11.14	1	7	0	86	423.494	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16265428
• 32479646
  

  Analogs

  702404

  

  Popular Name: methyl methyl

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Vitas-M

    • STL177243

  • eMolecules

    • 25984645

  • Molport

    • MolPort-002-759-023

  • Mcule

    • MCULE-7881675057

  • Princeton BioMolecular Research

    • OSSL_580917

  And 8 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)	4.47	9.24	-16.24	1	7	0	86	409.467	5	↓ MOL2 SDF SMILES Flexibase

  More about ZINC32479646
• 32674667
  

  Analogs

  702404

  

  Popular Name: ethyl 5-(4-methoxyphenyl)-7-methyl-3-oxo-2-(1H-pyrrol-2-ylmethylene)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate ethyl 5-(4-methoxyphenyl)-7-meth…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Specs

    • AF-399/41752539

  • eMolecules

    • 25956895

  • Molport

    • MolPort-023-226-306

  • ChemBridge

    • 7392946

  • Mcule

    • MCULE-6574940286

  And 9 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)	4.85	11.13	-10.76	1	7	0	86	423.494	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC32674667
• 702404
  

  Analogs

  702406

  

  2800768

  

  6393933

  

  8440165

  

  16265428

  

  Popular Name: (2Z,5S)-3-keto-5-(4-methoxyphenyl)-7-methyl-2-(1H-pyrrol-2-ylmethylene)-5H-thiazolo[3,2-a]pyrimidine (2Z,5S)-3-keto-5-(4-methoxypheny…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Mcule

    • MCULE-6574940286

  • UORSY

    • PB56863641

  • Scientific Exchange (make on demand)

    • M-156644

  • ChemDB

    • 4447558

  • PubChem

    • 2187589

  And 4 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)	4.85	1.4	-11.91	1	7	0	85	423.494	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC00702404
• 702406
  

  Analogs

  2800768

  

  6393933

  

  8440165

  

  16265428

  

  32479646

  

  Popular Name: (2Z,5R)-3-keto-5-(4-methoxyphenyl)-7-methyl-2-(1H-pyrrol-2-ylmethylene)-5H-thiazolo[3,2-a]pyrimidine (2Z,5R)-3-keto-5-(4-methoxypheny…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Mcule

    • MCULE-6574940286

  • UORSY

    • PB56863641

  • Scientific Exchange (make on demand)

    • M-156644

  • ChemDB

    • 4447558

  • PubChem

    • 2187591

  And 5 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)	4.85	1.23	-11.93	1	7	0	85	423.494	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC00702406
• 6393933
  

  Analogs

  8440165

  

  16265428

  

  32479646

  

  32674667

  

  702404

  

  Popular Name: methyl methyl

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Vitas-M

    • STL177243

  • eMolecules

    • 25984645

  • Molport

    • MolPort-002-759-023

  • Mcule

    • MCULE-7881675057

  • Princeton BioMolecular Research

    • OSSL_580917

  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)	4.47	0.66	-12.39	1	7	0	85	409.467	5	↓ MOL2 SDF SMILES Flexibase

  More about ZINC06393933
• 2800768
  

  Analogs

  8440165

  

  702404

  

  Popular Name: (2Z,5R)-3-keto-5-(4-methoxyphenyl)-7-methyl-2-(1H-pyrrol-2-ylmethylene)-5H-thiazolo[3,2-a]pyrimidine (2Z,5R)-3-keto-5-(4-methoxypheny…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • Mcule

    • MCULE-7881675057

  • ChemDB

    • 7175173

  • PubChem

    • 4776951

  • Mcule Make-on-demand

    • MCULE-7881675057

  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)	4.47	1.25	-12.12	1	7	0	85	409.467	5	↓ MOL2 SDF SMILES Flexibase

  More about ZINC02800768