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• Synonyms (0)
• Vendors (0)
• Annotations (4)
• Representations (1)
• Notes (0)
• Targets (0)
• Clustered (0)
• Reactome (0)
• Rings (0)
• Analogs (12)

ZINC49774609

• 49774609

Physical Representations

Activity (Go SEA)

• 16423909
  

  Analogs

  49774609

  

  49774610

  

  Popular Name: 3-(2-bromo-3,5-dimethoxy-phenyl)-2-[(1S)-1-ethylaminoethyl]quinazolin-4-one 3-(2-bromo-3,5-dimethoxy-phenyl)…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChemDB

    • 5872618

  • PubChem

    • 3949243

  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)	4.13	8.55	-40.96	2	6	1	70	433.326	6	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16423909
• 16423915
  

  Analogs

  49774609

  

  49774610

  

  Popular Name: 3-(2-bromo-3,5-dimethoxy-phenyl)-2-[(1S)-1-butylaminoethyl]quinazolin-4-one 3-(2-bromo-3,5-dimethoxy-phenyl)…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChemDB

    • 5872620

  • PubChem

    • 4426228

  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)	5.19	9.92	-44.29	2	6	1	70	461.38	8	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16423915
• 16423917
  

  Analogs

  49774609

  

  49774610

  

  Popular Name: 3-(2-bromo-3,5-dimethoxy-phenyl)-2-[(1R)-1-butylaminoethyl]quinazolin-4-one 3-(2-bromo-3,5-dimethoxy-phenyl)…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChemDB

    • 5872620

  • PubChem

    • 4426228

  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)	5.19	10.09	-42.18	2	6	1	70	461.38	8	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16423917
• 16423921
  

  Analogs

  19908671

  

  49774609

  

  49774610

  

  2182496

  

  Popular Name: 3-(2-bromo-3,5-dimethoxy-phenyl)-2-[(1R)-1-(phenethylamino)ethyl]quinazolin-4-one 3-(2-bromo-3,5-dimethoxy-phenyl)…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChemDB

    • 5872622

  • PubChem

    • 4562413

  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)	5.56	10.99	-13.82	1	6	0	65	508.416	8	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16423921
• 16423923
  

  Analogs

  19908671

  

  49774609

  

  49774610

  

  2182496

  

  Popular Name: 3-(2-bromo-3,5-dimethoxy-phenyl)-2-[(1S)-1-(phenethylamino)ethyl]quinazolin-4-one 3-(2-bromo-3,5-dimethoxy-phenyl)…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChemDB

    • 5872622

  • PubChem

    • 4562413

  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)	5.56	11.07	-13.12	1	6	0	65	508.416	8	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16423923
• 16424953
  

  Analogs

  44928641

  

  44928643

  

  49723082

  

  49723083

  

  49766921

  

  Popular Name: 4-bromo-N-[(1R)-1-[3-(4-methoxyphenyl)-4-oxo-quinazolin-2-yl]ethyl]-N-propyl-benzamide 4-bromo-N-[(1R)-1-[3-(4-methoxyp…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChemDB

    • 5874608

  • PubChem

    • 3935978

  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)	5.10	13.58	-12.59	0	6	0	64	520.427	7	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16424953
• 16426971
  

  Analogs

  35094407

  

  35094408

  

  45303272

  

  45303273

  

  49723198

  

  Popular Name: N-[(1S)-1-[3-(3,4-dimethylphenyl)-4-oxo-quinazolin-2-yl]ethyl]-N-isopentyl-3,5-dimethoxy-benzamide N-[(1S)-1-[3-(3,4-dimethylphenyl…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChemDB

    • 5875575

  • PubChem

    • 3912256

  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)	6.09	14.87	-16.96	0	7	0	74	527.665	9	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16426971
• 16426973
  

  Analogs

  35094407

  

  35094408

  

  45303272

  

  45303273

  

  49723198

  

  Popular Name: N-[(1R)-1-[3-(3,4-dimethylphenyl)-4-oxo-quinazolin-2-yl]ethyl]-N-isopentyl-3,5-dimethoxy-benzamide N-[(1R)-1-[3-(3,4-dimethylphenyl…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChemDB

    • 5875575

  • PubChem

    • 3912256

  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)	6.09	14.88	-16.3	0	7	0	74	527.665	9	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16426973
• 16429443
  

  Analogs

  36184719

  

  36184720

  

  44018141

  

  44018143

  

  49774609

  

  Popular Name: N-[(1S)-1-[3-(2-bromo-3,5-dimethoxy-phenyl)-4-oxo-quinazolin-2-yl]ethyl]-N-isobutyl-butanamide N-[(1S)-1-[3-(2-bromo-3,5-dimeth…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 42722169

  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)	5.88	12.68	-15.34	0	7	0	74	530.463	9	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16429443
• 16429445
  

  Analogs

  36184719

  

  36184720

  

  44018141

  

  44018143

  

  49774609

  

  Popular Name: N-[(1R)-1-[3-(2-bromo-3,5-dimethoxy-phenyl)-4-oxo-quinazolin-2-yl]ethyl]-N-isobutyl-butanamide N-[(1R)-1-[3-(2-bromo-3,5-dimeth…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 42722169

  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)	5.88	12.23	-16.18	0	7	0	74	530.463	9	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16429445
• 16429663
  

  Analogs

  36184719

  

  36184720

  

  43490768

  

  43490771

  

  44018141

  

  Popular Name: N-[(1S)-1-[3-(2-bromo-3,5-dimethoxy-phenyl)-4-oxo-quinazolin-2-yl]ethyl]-N-methyl-hexanamide N-[(1S)-1-[3-(2-bromo-3,5-dimeth…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 42722381

  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)	5.77	12.38	-16.44	0	7	0	74	516.436	9	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16429663
• 16429666
  

  Analogs

  36184719

  

  36184720

  

  43490768

  

  43490771

  

  44018141

  

  Popular Name: N-[(1R)-1-[3-(2-bromo-3,5-dimethoxy-phenyl)-4-oxo-quinazolin-2-yl]ethyl]-N-methyl-hexanamide N-[(1R)-1-[3-(2-bromo-3,5-dimeth…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 42722381

  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)	5.77	12.17	-17.65	0	7	0	74	516.436	9	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16429666