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ZINC Item

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64977337

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-[[2-(4-ethoxyphenyl)-5-methyl-oxazol-4-yl]methyl]-2-(2-methoxyphenyl)pyrazolo[1,5-a]pyrazin-4-one 5-[[2-(4-ethoxyphenyl)-5-methyl-…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.43	9.68	-15.51	0	8	0	84	456.502	7	↓ MOL2 SDF SMILES Flexibase

64977340

Analogs

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Popular Name: 5-[[2-(4-isopropoxyphenyl)-5-methyl-oxazol-4-yl]methyl]-2-(2-methoxyphenyl)pyrazolo[1,5-a]pyrazin-4- 5-[[2-(4-isopropoxyphenyl)-5-met…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.80	10.23	-25.01	0	8	0	84	470.529	7	↓ MOL2 SDF SMILES Flexibase

64977341

Analogs

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Popular Name: 5-[[2-(2,3-dimethoxyphenyl)-5-methyl-oxazol-4-yl]methyl]-2-(2-methoxyphenyl)pyrazolo[1,5-a]pyrazin-4 5-[[2-(2,3-dimethoxyphenyl)-5-me…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.82	9.38	-28.04	0	9	0	93	472.501	7	↓ MOL2 SDF SMILES Flexibase

64977342

Analogs

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Popular Name: 5-[[2-(4-ethoxy-3-methoxy-phenyl)-5-methyl-oxazol-4-yl]methyl]-2-(2-methoxyphenyl)pyrazolo[1,5-a]pyr 5-[[2-(4-ethoxy-3-methoxy-phenyl…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.02	9.59	-17.76	0	9	0	93	486.528	8	↓ MOL2 SDF SMILES Flexibase

64977343

Analogs

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Popular Name: 5-[[2-(2-ethoxyphenyl)-5-methyl-oxazol-4-yl]methyl]-2-(2-methoxyphenyl)pyrazolo[1,5-a]pyrazin-4-one 5-[[2-(2-ethoxyphenyl)-5-methyl-…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.39	10.55	-18.03	0	8	0	84	456.502	7	↓ MOL2 SDF SMILES Flexibase

64977394

Analogs

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Popular Name: 5-[[2-(2,4-dimethoxyphenyl)-5-methyl-oxazol-4-yl]methyl]-2-(4-methoxyphenyl)pyrazolo[1,5-a]pyrazin-4 5-[[2-(2,4-dimethoxyphenyl)-5-me…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.09	8.57	-25.15	0	9	0	93	472.501	7	↓ MOL2 SDF SMILES Flexibase

64977408

Analogs

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Popular Name: 2-(4-chlorophenyl)-5-[[2-(2,4-dimethoxyphenyl)-5-methyl-oxazol-4-yl]methyl]pyrazolo[1,5-a]pyrazin-4- 2-(4-chlorophenyl)-5-[[2-(2,4-di…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.71	9.8	-23.28	0	8	0	84	476.92	6	↓ MOL2 SDF SMILES Flexibase

64977419

Analogs

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Popular Name: 5-[[2-(2,3-dimethoxyphenyl)-5-methyl-oxazol-4-yl]methyl]-2-(4-fluorophenyl)pyrazolo[1,5-a]pyrazin-4- 5-[[2-(2,3-dimethoxyphenyl)-5-me…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.98	9.87	-24.92	0	8	0	84	460.465	6	↓ MOL2 SDF SMILES Flexibase

64977420

Analogs

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Popular Name: 5-[[2-(4-ethoxy-3-methoxy-phenyl)-5-methyl-oxazol-4-yl]methyl]-2-(4-fluorophenyl)pyrazolo[1,5-a]pyra 5-[[2-(4-ethoxy-3-methoxy-phenyl…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.18	10.08	-14.91	0	8	0	84	474.492	7	↓ MOL2 SDF SMILES Flexibase

64977424

Analogs

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Popular Name: 2-(4-fluorophenyl)-5-[[5-methyl-2-(3,4,5-trimethoxyphenyl)oxazol-4-yl]methyl]pyrazolo[1,5-a]pyrazin- 2-(4-fluorophenyl)-5-[[5-methyl-…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.79	9.01	-24.85	0	9	0	93	490.491	7	↓ MOL2 SDF SMILES Flexibase

64977426

Analogs

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Popular Name: 5-[[2-(2,4-dimethoxyphenyl)-5-methyl-oxazol-4-yl]methyl]-2-(4-fluorophenyl)pyrazolo[1,5-a]pyrazin-4- 5-[[2-(2,4-dimethoxyphenyl)-5-me…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.20	9.35	-23.64	0	8	0	84	460.465	6	↓ MOL2 SDF SMILES Flexibase

64977443

Analogs

12414765
12414768

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4-ethoxyphenyl)-5-[[2-(4-ethoxyphenyl)-5-methyl-oxazol-4-yl]methyl]pyrazolo[1,5-a]pyrazin-4-one 2-(4-ethoxyphenyl)-5-[[2-(4-etho…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.86	10.32	-13.45	0	8	0	84	470.529	8	↓ MOL2 SDF SMILES Flexibase

64977447

Analogs

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Popular Name: 5-[[2-(2,3-dimethoxyphenyl)-5-methyl-oxazol-4-yl]methyl]-2-(4-ethoxyphenyl)pyrazolo[1,5-a]pyrazin-4- 5-[[2-(2,3-dimethoxyphenyl)-5-me…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.25	10.09	-17.16	0	9	0	93	486.528	8	↓ MOL2 SDF SMILES Flexibase

64977448

Analogs

12414771

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Popular Name: 2-(4-ethoxyphenyl)-5-[[2-(2-ethoxyphenyl)-5-methyl-oxazol-4-yl]methyl]pyrazolo[1,5-a]pyrazin-4-one 2-(4-ethoxyphenyl)-5-[[2-(2-etho…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.81	11.19	-16.01	0	8	0	84	470.529	8	↓ MOL2 SDF SMILES Flexibase

64977451

Analogs

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Popular Name: 5-[[2-(2,4-dimethoxyphenyl)-5-methyl-oxazol-4-yl]methyl]-2-(4-ethoxyphenyl)pyrazolo[1,5-a]pyrazin-4- 5-[[2-(2,4-dimethoxyphenyl)-5-me…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.47	9.58	-16.31	0	9	0	93	486.528	8	↓ MOL2 SDF SMILES Flexibase

64977452

Analogs

12414765
12414768

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4-ethoxyphenyl)-5-[[2-(4-methoxyphenyl)-5-methyl-oxazol-4-yl]methyl]pyrazolo[1,5-a]pyrazin-4-one 2-(4-ethoxyphenyl)-5-[[2-(4-meth…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.48	9.39	-13.79	0	8	0	84	456.502	7	↓ MOL2 SDF SMILES Flexibase

64977473

Analogs

12414770

Draw Identity 99% 90% 80% 70%

Popular Name: 5-[[2-(4-ethoxy-3-methoxy-phenyl)-5-methyl-oxazol-4-yl]methyl]-2-phenyl-pyrazolo[1,5-a]pyrazin-4-one 5-[[2-(4-ethoxy-3-methoxy-phenyl…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.01	10.01	-15.46	0	8	0	84	456.502	7	↓ MOL2 SDF SMILES Flexibase

64977490

Analogs

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Popular Name: 5-[[5-methyl-2-(3,4,5-trimethoxyphenyl)oxazol-4-yl]methyl]-2-phenyl-pyrazolo[1,5-a]pyrazin-4-one 5-[[5-methyl-2-(3,4,5-trimethoxy…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.62	8.94	-25.73	0	9	0	93	472.501	7	↓ MOL2 SDF SMILES Flexibase

64977521

Analogs

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Popular Name: 2-(3,4-dimethoxyphenyl)-5-[[5-methyl-2-(p-tolyl)oxazol-4-yl]methyl]pyrazolo[1,5-a]pyrazin-4-one 2-(3,4-dimethoxyphenyl)-5-[[5-me…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.09	9.77	-15.88	0	8	0	84	456.502	6	↓ MOL2 SDF SMILES Flexibase

64977522

Analogs

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Popular Name: 2-(3,4-dimethoxyphenyl)-5-[[2-(4-ethoxyphenyl)-5-methyl-oxazol-4-yl]methyl]pyrazolo[1,5-a]pyrazin-4- 2-(3,4-dimethoxyphenyl)-5-[[2-(4…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.07	9.31	-16.1	0	9	0	93	486.528	8	↓ MOL2 SDF SMILES Flexibase

64977523

Analogs

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Popular Name: 5-[[2-(3-chlorophenyl)-5-methyl-oxazol-4-yl]methyl]-2-(3,4-dimethoxyphenyl)pyrazolo[1,5-a]pyrazin-4- 5-[[2-(3-chlorophenyl)-5-methyl-…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.29	9.52	-24.59	0	8	0	84	476.92	6	↓ MOL2 SDF SMILES Flexibase

64977524

Analogs

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Popular Name: 5-[[2-(4-chlorophenyl)-5-methyl-oxazol-4-yl]methyl]-2-(3,4-dimethoxyphenyl)pyrazolo[1,5-a]pyrazin-4- 5-[[2-(4-chlorophenyl)-5-methyl-…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.32	9.53	-24.41	0	8	0	84	476.92	6	↓ MOL2 SDF SMILES Flexibase

64977525

Analogs

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Popular Name: 2-(3,4-dimethoxyphenyl)-5-[[2-(2-ethoxyphenyl)-5-methyl-oxazol-4-yl]methyl]pyrazolo[1,5-a]pyrazin-4- 2-(3,4-dimethoxyphenyl)-5-[[2-(2…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.02	10.19	-18.52	0	9	0	93	486.528	8	↓ MOL2 SDF SMILES Flexibase

64977526

Analogs

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Popular Name: 2-(3,4-dimethoxyphenyl)-5-[[5-methyl-2-(o-tolyl)oxazol-4-yl]methyl]pyrazolo[1,5-a]pyrazin-4-one 2-(3,4-dimethoxyphenyl)-5-[[5-me…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.04	9.53	-16.03	0	8	0	84	456.502	6	↓ MOL2 SDF SMILES Flexibase

64977527

Analogs

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Popular Name: 2-(3,4-dimethoxyphenyl)-5-[[2-(2-methoxyphenyl)-5-methyl-oxazol-4-yl]methyl]pyrazolo[1,5-a]pyrazin-4 2-(3,4-dimethoxyphenyl)-5-[[2-(2…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.65	9.19	-27.71	0	9	0	93	472.501	7	↓ MOL2 SDF SMILES Flexibase

64977529

Analogs

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Popular Name: 2-(3,4-dimethoxyphenyl)-5-[[2-(4-methoxyphenyl)-5-methyl-oxazol-4-yl]methyl]pyrazolo[1,5-a]pyrazin-4 2-(3,4-dimethoxyphenyl)-5-[[2-(4…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.70	8.32	-26.27	0	9	0	93	472.501	7	↓ MOL2 SDF SMILES Flexibase

65331054

Analogs

12414770

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Popular Name: 5-[[2-(4-ethoxy-3-methoxy-phenyl)-5-methyl-oxazol-4-yl]methyl]-2-(4-ethoxyphenyl)pyrazolo[1,5-a]pyra 5-[[2-(4-ethoxy-3-methoxy-phenyl…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.45	10.23	-15.84	0	9	0	93	500.555	9	↓ MOL2 SDF SMILES Flexibase

65331055

Analogs

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Popular Name: 2-(4-ethoxyphenyl)-5-[[5-methyl-2-(3,4,5-trimethoxyphenyl)oxazol-4-yl]methyl]pyrazolo[1,5-a]pyrazin- 2-(4-ethoxyphenyl)-5-[[5-methyl-…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.06	9.25	-16.44	0	10	0	102	516.554	9	↓ MOL2 SDF SMILES Flexibase

65331058

Analogs

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Popular Name: 2-(3,4-dimethoxyphenyl)-5-[[2-(4-isopropoxyphenyl)-5-methyl-oxazol-4-yl]methyl]pyrazolo[1,5-a]pyrazi 2-(3,4-dimethoxyphenyl)-5-[[2-(4…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.43	9.86	-25.37	0	9	0	93	500.555	8	↓ MOL2 SDF SMILES Flexibase

65331059

Analogs

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Popular Name: 2-(3,4-dimethoxyphenyl)-5-[[2-(2,3-dimethoxyphenyl)-5-methyl-oxazol-4-yl]methyl]pyrazolo[1,5-a]pyraz 2-(3,4-dimethoxyphenyl)-5-[[2-(2…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.46	9.02	-28.45	0	10	0	102	502.527	8	↓ MOL2 SDF SMILES Flexibase

65331060

Analogs

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Popular Name: 2-(3,4-dimethoxyphenyl)-5-[[2-(2,4-dimethoxyphenyl)-5-methyl-oxazol-4-yl]methyl]pyrazolo[1,5-a]pyraz 2-(3,4-dimethoxyphenyl)-5-[[2-(2…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.68	8.5	-27.22	0	10	0	102	502.527	8	↓ MOL2 SDF SMILES Flexibase

65331061

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Popular Name: 5-[[2-(5-bromo-2-methoxy-phenyl)-5-methyl-oxazol-4-yl]methyl]-2-(3,4-dimethylphenyl)pyrazolo[1,5-a]p 5-[[2-(5-bromo-2-methoxy-phenyl)…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	6.61	11.89	-14.72	0	7	0	75	519.399	5	↓ MOL2 SDF SMILES Flexibase

65331062

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Popular Name: 2-(3,4-dimethylphenyl)-5-[[5-methyl-2-(3,4,5-trimethoxyphenyl)oxazol-4-yl]methyl]pyrazolo[1,5-a]pyra 2-(3,4-dimethylphenyl)-5-[[5-met…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.45	10.25	-16.24	0	9	0	93	500.555	7	↓ MOL2 SDF SMILES Flexibase

65331063

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Popular Name: 5-[[2-(5-bromo-2-methoxy-phenyl)-5-methyl-oxazol-4-yl]methyl]-2-(4-ethylphenyl)pyrazolo[1,5-a]pyrazi 5-[[2-(5-bromo-2-methoxy-phenyl)…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	6.70	12.11	-14.19	0	7	0	75	519.399	6	↓ MOL2 SDF SMILES Flexibase

65331064

Analogs

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Popular Name: 2-(4-ethylphenyl)-5-[[5-methyl-2-(3,4,5-trimethoxyphenyl)oxazol-4-yl]methyl]pyrazolo[1,5-a]pyrazin-4 2-(4-ethylphenyl)-5-[[5-methyl-2…

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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 (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.54	10.46	-15.76	0	9	0	93	500.555	8	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

ring.id = 373069
filter.purchasability = annotated
page.format = targets
page.num = 1

Structural Results Found: (before additional filtering)

SQL Query Was

SELECT DISTINCT(ci.sub_id_fk) AS sub_id FROM catalog_item AS ci INNER JOIN catalog AS c ON ci.cat_id_fk=c.cat_id INNER JOIN hasring AS hr ON ci.sub_id_fk=hr.sub_id_fk INNER JOIN rings AS r ON hr.rings_fk=r.rings_id  WHERE r.rings_id = 373069 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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<script type="text/javascript" src="//zinc12.docking.org/js/embed.js"></script>
<script type="text/javascript">
    window.zinc.embed('zinc-link', {
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