User Information

• Synonyms (0)
• Vendors (0)
• Annotations (4)
• Representations (1)
• Notes (0)
• Targets (0)
• Clustered (0)
• Reactome (0)
• Rings (0)
• Analogs (29)

ZINC49723044

• 49723044

Physical Representations

Activity (Go SEA)

• 16424749
  

  Analogs

  35072214

  

  35072215

  

  49723044

  

  49723045

  

  49745350

  

  Popular Name: N-[(1S)-1-[3-(4-chlorophenyl)-4-oxo-quinazolin-2-yl]propyl]-N-hexyl-2-phenoxy-acetamide N-[(1S)-1-[3-(4-chlorophenyl)-4-…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChemDB

    • 5874424

  • PubChem

    • 4018504

  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)	7.43	18.02	-13.49	0	6	0	64	532.084	12	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16424749
• 16424751
  

  Analogs

  35072214

  

  35072215

  

  49723044

  

  49723045

  

  49745350

  

  Popular Name: N-[(1R)-1-[3-(4-chlorophenyl)-4-oxo-quinazolin-2-yl]propyl]-N-hexyl-2-phenoxy-acetamide N-[(1R)-1-[3-(4-chlorophenyl)-4-…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChemDB

    • 5874424

  • PubChem

    • 4018504

  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)	7.43	18.61	-14.7	0	6	0	64	532.084	12	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16424751
• 16424985
  

  Analogs

  28707852

  

  35072214

  

  35072215

  

  49723044

  

  49723045

  

  Popular Name: N-[(1R)-1-[3-(4-ethoxyphenyl)-4-oxo-quinazolin-2-yl]propyl]-N-(2-methoxyethyl)-2-phenoxy-acetamide N-[(1R)-1-[3-(4-ethoxyphenyl)-4-…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 42716634

  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)	4.72	14.19	-15.45	0	8	0	83	515.61	12	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16424985
• 16425044
  

  Analogs

  28707852

  

  35072214

  

  35072215

  

  49723044

  

  49723045

  

  Popular Name: N-[(1R)-1-[3-(4-ethoxyphenyl)-4-oxo-quinazolin-2-yl]propyl]-2-phenoxy-N-propyl-acetamide N-[(1R)-1-[3-(4-ethoxyphenyl)-4-…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChemDB

    • 5874639

  • PubChem

    • 4017231

  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)	5.61	15.98	-16.98	0	7	0	74	499.611	11	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16425044
• 16425506
  

  Analogs

  28707852

  

  35072214

  

  35072215

  

  36184719

  

  36184720

  

  Popular Name: N-[(1R)-1-[3-(4-ethoxyphenyl)-4-oxo-quinazolin-2-yl]propyl]-N-isopentyl-3-methyl-butanamide N-[(1R)-1-[3-(4-ethoxyphenyl)-4-…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 42717874

  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)	6.36	15.26	-12.6	0	6	0	64	477.649	11	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16425506
• 16425530
  

  Analogs

  35072214

  

  35072215

  

  36184719

  

  36184720

  

  44018141

  

  Popular Name: N-butyl-2-chloro-N-[(1S)-1-[7-chloro-3-(4-methoxyphenyl)-4-oxo-quinazolin-2-yl]ethyl]acetamide N-butyl-2-chloro-N-[(1S)-1-[7-ch…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChemDB

    • 5874986

  • PubChem

    • 3885808

  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)	4.87	12.25	-16.35	0	6	0	64	462.377	8	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16425530
• 16425532
  

  Analogs

  35072214

  

  35072215

  

  36184719

  

  36184720

  

  44018141

  

  Popular Name: N-butyl-2-chloro-N-[(1R)-1-[7-chloro-3-(4-methoxyphenyl)-4-oxo-quinazolin-2-yl]ethyl]acetamide N-butyl-2-chloro-N-[(1R)-1-[7-ch…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChemDB

    • 5874986

  • PubChem

    • 3885808

  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)	4.87	12.24	-15.42	0	6	0	64	462.377	8	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16425532
• 16426008
  

  Analogs

  35072214

  

  35072215

  

  36184719

  

  36184720

  

  44018141

  

  Popular Name: 2-chloro-N-[(1R)-1-[7-chloro-3-(4-methoxyphenyl)-4-oxo-quinazolin-2-yl]ethyl]-N-isopentyl-acetamide 2-chloro-N-[(1R)-1-[7-chloro-3-(…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChemDB

    • 5875173

  • PubChem

    • 4425413

  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)	5.09	12.56	-12.84	0	6	0	64	476.404	8	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16426008
• 16426915
  

  Analogs

  35072214

  

  35072215

  

  49723044

  

  49723045

  

  49745019

  

  Popular Name: N-butyl-N-[(1S)-1-[3-(3,4-dimethylphenyl)-4-oxo-quinazolin-2-yl]ethyl]-2-phenoxy-acetamide N-butyl-N-[(1S)-1-[3-(3,4-dimeth…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • American Custom Chemicals Corp.

    • CHM0174329

  • ChemDB

    • 5875551

  • PubChem

    • 4359754

  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)	6.27	16.24	-14.36	0	6	0	64	483.612	9	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16426915
• 16426918
  

  Analogs

  49723044

  

  49723045

  

  49745350

  

  49745352

  

  Popular Name: N-butyl-2-(4-chlorophenoxy)-N-[(1S)-1-[3-(3,4-dimethylphenyl)-4-oxo-quinazolin-2-yl]ethyl]acetamide N-butyl-2-(4-chlorophenoxy)-N-[(…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • American Custom Chemicals Corp.

    • HCH0152418

  • ChemDB

    • 5875552

  • PubChem

    • 3979869

  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)	6.95	16.76	-14.1	0	6	0	64	518.057	9	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16426918
• 16428265
  

  Analogs

  29043264

  

  35072214

  

  35072215

  

  35094407

  

  35094408

  

  Popular Name: N-[(1S)-1-[3-(2-methoxyphenyl)-4-oxo-quinazolin-2-yl]ethyl]-N-pentyl-2-phenoxy-acetamide N-[(1S)-1-[3-(2-methoxyphenyl)-4…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChemDB

    • 5876439

  • PubChem

    • 4436898

  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)	5.96	15.68	-18.69	0	7	0	74	499.611	11	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16428265
• 16428268
  

  Analogs

  29043264

  

  35072214

  

  35072215

  

  35094407

  

  35094408

  

  Popular Name: N-[(1R)-1-[3-(2-methoxyphenyl)-4-oxo-quinazolin-2-yl]ethyl]-N-pentyl-2-phenoxy-acetamide N-[(1R)-1-[3-(2-methoxyphenyl)-4…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChemDB

    • 5876439

  • PubChem

    • 4436898

  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)	5.96	15.85	-18.43	0	7	0	74	499.611	11	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16428268
• 16428460
  

  Analogs

  35072214

  

  35072215

  

  49604939

  

  49604940

  

  49604956

  

  Popular Name: N-[(1R)-1-[3-(3-chlorophenyl)-4-oxo-quinazolin-2-yl]propyl]-N-isopentyl-2-phenoxy-acetamide N-[(1R)-1-[3-(3-chlorophenyl)-4-…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChemDB

    • 5876601

  • PubChem

    • 3917650

  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)	6.82	17.66	-17.96	0	6	0	64	518.057	10	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16428460
• 16429083
  

  Analogs

  49604956

  

  49604957

  

  49723044

  

  49723045

  

  49745019

  

  Popular Name: 2-(4-chlorophenoxy)-N-[(1S)-1-[3-(4-ethylphenyl)-4-oxo-quinazolin-2-yl]ethyl]-N-propyl-acetamide 2-(4-chlorophenoxy)-N-[(1S)-1-[3…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChemDB

    • 5876976

  • PubChem

    • 3993359

  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)	6.27	16.84	-15.81	0	6	0	64	504.03	9	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16429083
• 16429084
  

  Analogs

  49604956

  

  49604957

  

  49723044

  

  49723045

  

  49745019

  

  Popular Name: 2-(4-chlorophenoxy)-N-[(1R)-1-[3-(4-ethylphenyl)-4-oxo-quinazolin-2-yl]ethyl]-N-propyl-acetamide 2-(4-chlorophenoxy)-N-[(1R)-1-[3…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChemDB

    • 5876976

  • PubChem

    • 3993359

  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)	6.27	16.82	-15.76	0	6	0	64	504.03	9	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16429084
• 16430076
  

  Analogs

  35072214

  

  35072215

  

  49723044

  

  49723045

  

  49745350

  

  Popular Name: N-[(1R)-1-[3-(4-ethylphenyl)-4-oxo-quinazolin-2-yl]propyl]-N-isopentyl-2-phenoxy-acetamide N-[(1R)-1-[3-(4-ethylphenyl)-4-o…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChemDB

    • 5877894

  • PubChem

    • 3621109

  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)	6.87	18.5	-15.54	0	6	0	64	511.666	11	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16430076
• 16430078
  

  Analogs

  35072214

  

  35072215

  

  49723044

  

  49723045

  

  49745350

  

  Popular Name: N-[(1S)-1-[3-(4-ethylphenyl)-4-oxo-quinazolin-2-yl]propyl]-N-isopentyl-2-phenoxy-acetamide N-[(1S)-1-[3-(4-ethylphenyl)-4-o…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChemDB

    • 5877894

  • PubChem

    • 3621109

  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)	6.87	17.9	-13.55	0	6	0	64	511.666	11	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16430078
• 16430567
  

  Analogs

  35072214

  

  35072215

  

  35094407

  

  35094408

  

  35094425

  

  Popular Name: N-isopentyl-N-[(1S)-1-[3-(2-methoxyphenyl)-4-oxo-quinazolin-2-yl]propyl]-2-phenoxy-acetamide N-isopentyl-N-[(1S)-1-[3-(2-meth…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • PubChem

    • 42723326

  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)	6.17	16.5	-18.14	0	7	0	74	513.638	11	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16430567
• 16431070
  

  Analogs

  35072214

  

  35072215

  

  49723044

  

  49723045

  

  49745019

  

  Popular Name: N-[(1S)-1-[3-(4-chlorophenyl)-4-oxo-quinazolin-2-yl]ethyl]-N-(3-methoxypropyl)-2-phenoxy-acetamide N-[(1S)-1-[3-(4-chlorophenyl)-4-…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChemDB

    • 5879340

  • PubChem

    • 3365165

  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)	4.73	13.63	-16.07	0	7	0	74	506.002	10	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16431070
• 16431072
  

  Analogs

  35072214

  

  35072215

  

  49723044

  

  49723045

  

  49745019

  

  Popular Name: N-[(1R)-1-[3-(4-chlorophenyl)-4-oxo-quinazolin-2-yl]ethyl]-N-(3-methoxypropyl)-2-phenoxy-acetamide N-[(1R)-1-[3-(4-chlorophenyl)-4-…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChemDB

    • 5879340

  • PubChem

    • 3365165

  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)	4.73	14.45	-16.49	0	7	0	74	506.002	10	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16431072
• 16431191
  

  Analogs

  35072214

  

  35072215

  

  36184719

  

  36184720

  

  44018141

  

  Popular Name: 3-cyclopentyl-N-[(1R)-1-[3-(4-ethoxyphenyl)-4-oxo-quinazolin-2-yl]propyl]-N-(3-methoxypropyl)propana 3-cyclopentyl-N-[(1R)-1-[3-(4-et…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChemDB

    • 5879411

  • PubChem

    • 4314729

  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)	5.63	15.56	-13.87	0	7	0	74	519.686	13	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16431191
• 16431194
  

  Analogs

  35072214

  

  35072215

  

  36184719

  

  36184720

  

  44018141

  

  Popular Name: 3-cyclopentyl-N-[(1S)-1-[3-(4-ethoxyphenyl)-4-oxo-quinazolin-2-yl]propyl]-N-(3-methoxypropyl)propana 3-cyclopentyl-N-[(1S)-1-[3-(4-et…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChemDB

    • 5879411

  • PubChem

    • 4314729

  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)	5.63	15	-13.71	0	7	0	74	519.686	13	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16431194
• 16431207
  

  Analogs

  28707852

  

  35072214

  

  35072215

  

  36184719

  

  36184720

  

  Popular Name: N-[(1R)-1-[3-(4-ethoxyphenyl)-4-oxo-quinazolin-2-yl]propyl]-N-(3-methoxypropyl)cyclopentanecarboxami N-[(1R)-1-[3-(4-ethoxyphenyl)-4-…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChemDB

    • 5879423

  • PubChem

    • 3460725

  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)	5.09	14.01	-17.85	0	7	0	74	491.632	11	↓ MOL2 SDF SMILES Flexibase

  More about ZINC16431207
• 33771102
  

  Analogs

  35072214

  

  35072215

  

  35689174

  

  35689176

  

  45301289

  

  Popular Name: ethyl ethyl

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChemDB

    • 5876204

  • PubChem

    • 5186913

  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)	4.33	14.38	-14.08	0	7	0	82	469.969	10	↓ MOL2 SDF SMILES Flexibase

  More about ZINC33771102
• 33771103
  

  Analogs

  35072214

  

  35072215

  

  35689174

  

  35689176

  

  45301289

  

  Popular Name: ethyl ethyl

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChemDB

    • 5876204

  • PubChem

    • 5186913

  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)	4.33	13.88	-11.98	0	7	0	82	469.969	10	↓ MOL2 SDF SMILES Flexibase

  More about ZINC33771103
• 33771166
  

  Analogs

  35072214

  

  35072215

  

  41265726

  

  49723044

  

  49723045

  

  Popular Name: N-(6-aminohexyl)-N-[(1S)-1-(7-chloro-3-methyl-4-oxo-quinazolin-2-yl)ethyl]-2-(4-chlorophenoxy)acetam N-(6-aminohexyl)-N-[(1S)-1-(7-ch…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChemDB

    • 5901621

  • PubChem

    • 5187072

  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)	4.21	11.97	-55.17	3	7	1	92	506.454	11	↓ MOL2 SDF SMILES Flexibase

  More about ZINC33771166
• 33771167
  

  Analogs

  35072214

  

  35072215

  

  41265726

  

  49723044

  

  49723045

  

  Popular Name: N-(6-aminohexyl)-N-[(1R)-1-(7-chloro-3-methyl-4-oxo-quinazolin-2-yl)ethyl]-2-(4-chlorophenoxy)acetam N-(6-aminohexyl)-N-[(1R)-1-(7-ch…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChemDB

    • 5901621

  • PubChem

    • 5187072

  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)	4.21	11.91	-53.67	3	7	1	92	506.454	11	↓ MOL2 SDF SMILES Flexibase

  More about ZINC33771167
• 34859184
  

  Analogs

  35072214

  

  35072215

  

  36184719

  

  36184720

  

  44018141

  

  Popular Name: N-[(1S)-1-[3-(4-ethoxyphenyl)-4-oxo-quinazolin-2-yl]propyl]-N-(3-methoxypropyl)cyclohexanecarboxamid N-[(1S)-1-[3-(4-ethoxyphenyl)-4-…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChemDB

    • 5879410

  • PubChem

    • 4398939

  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)	5.59	14.42	-18.76	0	7	0	74	505.659	11	↓ MOL2 SDF SMILES Flexibase

  More about ZINC34859184
• 34859185
  

  Analogs

  35072214

  

  35072215

  

  36184719

  

  36184720

  

  44018141

  

  Popular Name: N-[(1R)-1-[3-(4-ethoxyphenyl)-4-oxo-quinazolin-2-yl]propyl]-N-(3-methoxypropyl)cyclohexanecarboxamid N-[(1R)-1-[3-(4-ethoxyphenyl)-4-…

  Find On: PubMed — Wikipedia — Google

  Vendors

  • ChemDB

    • 5879410

  • PubChem

    • 4398939

  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)	5.59	14.06	-15.33	0	7	0	74	505.659	11	↓ MOL2 SDF SMILES Flexibase

  More about ZINC34859185