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ZINC Item

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65155785

Analogs

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Popular Name: 2-(1-ethylpyrrolo[2,3-b]pyridin-3-yl)-N-(m-tolylmethyl)acetamide 2-(1-ethylpyrrolo[2,3-b]pyridin-…

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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)	2.74	9.84	-13.81	1	4	0	47	307.397	5	↓ MOL2 SDF SMILES Flexibase

65155787

Analogs

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Popular Name: 2-(1-ethylpyrrolo[2,3-b]pyridin-3-yl)-N-[(3-fluorophenyl)methyl]acetamide 2-(1-ethylpyrrolo[2,3-b]pyridin-…

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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)	2.46	9.24	-14.86	1	4	0	47	311.36	5	↓ MOL2 SDF SMILES Flexibase

65155799

Analogs

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Popular Name: 2-(1-ethylpyrrolo[2,3-b]pyridin-3-yl)-N-[(2-methoxyphenyl)methyl]acetamide 2-(1-ethylpyrrolo[2,3-b]pyridin-…

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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)	2.33	8.51	-15.36	1	5	0	56	323.396	6	↓ MOL2 SDF SMILES Flexibase

65155803

Analogs

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Popular Name: N-[(2,5-difluorophenyl)methyl]-2-(1-ethylpyrrolo[2,3-b]pyridin-3-yl)acetamide N-[(2,5-difluorophenyl)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)	2.57	9.26	-14.57	1	4	0	47	329.35	5	↓ MOL2 SDF SMILES Flexibase

65155816

Analogs

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Popular Name: N-benzyl-2-(1-ethylpyrrolo[2,3-b]pyridin-3-yl)acetamide N-benzyl-2-(1-ethylpyrrolo[2,3-b…

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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)	2.32	9.17	-13.8	1	4	0	47	293.37	5	↓ MOL2 SDF SMILES Flexibase

65155821

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(1-ethylpyrrolo[2,3-b]pyridin-3-yl)-N-[(1S)-1-phenylethyl]acetamide 2-(1-ethylpyrrolo[2,3-b]pyridin-…

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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)	2.88	10	-14.41	1	4	0	47	307.397	5	↓ MOL2 SDF SMILES Flexibase

65155822

Analogs

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Popular Name: 2-(1-ethylpyrrolo[2,3-b]pyridin-3-yl)-N-[(1R)-1-phenylethyl]acetamide 2-(1-ethylpyrrolo[2,3-b]pyridin-…

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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)	2.88	10.01	-14.24	1	4	0	47	307.397	5	↓ MOL2 SDF SMILES Flexibase

65155825

Analogs

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Popular Name: N-benzyl-N-ethyl-2-(1-ethylpyrrolo[2,3-b]pyridin-3-yl)acetamide N-benzyl-N-ethyl-2-(1-ethylpyrro…

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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)	2.94	12.19	-14.41	0	4	0	38	321.424	6	↓ MOL2 SDF SMILES Flexibase

65155832

Analogs

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Popular Name: 2-(1-ethylpyrrolo[2,3-b]pyridin-3-yl)-N-[(4-fluorophenyl)methyl]acetamide 2-(1-ethylpyrrolo[2,3-b]pyridin-…

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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)	2.48	9.24	-14.53	1	4	0	47	311.36	5	↓ MOL2 SDF SMILES Flexibase

65155840

Analogs

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Popular Name: 2-(1-ethylpyrrolo[2,3-b]pyridin-3-yl)-N-[(4-methoxyphenyl)methyl]acetamide 2-(1-ethylpyrrolo[2,3-b]pyridin-…

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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)	2.37	8.47	-15.06	1	5	0	56	323.396	6	↓ MOL2 SDF SMILES Flexibase

65155841

Analogs

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Popular Name: 2-(1-ethylpyrrolo[2,3-b]pyridin-3-yl)-N-[(2-fluorophenyl)methyl]acetamide 2-(1-ethylpyrrolo[2,3-b]pyridin-…

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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)	2.43	9.19	-15.27	1	4	0	47	311.36	5	↓ MOL2 SDF SMILES Flexibase

65155842

Analogs

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Popular Name: N-[(2,4-difluorophenyl)methyl]-2-(1-ethylpyrrolo[2,3-b]pyridin-3-yl)acetamide N-[(2,4-difluorophenyl)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)	2.57	9.26	-15.04	1	4	0	47	329.35	5	↓ MOL2 SDF SMILES Flexibase

65155843

Analogs

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Popular Name: N-[(3,5-difluorophenyl)methyl]-2-(1-ethylpyrrolo[2,3-b]pyridin-3-yl)acetamide N-[(3,5-difluorophenyl)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)	2.57	9.31	-14.17	1	4	0	47	329.35	5	↓ MOL2 SDF SMILES Flexibase

65155844

Analogs

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Popular Name: 2-(1-ethylpyrrolo[2,3-b]pyridin-3-yl)-N-(o-tolylmethyl)acetamide 2-(1-ethylpyrrolo[2,3-b]pyridin-…

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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)	2.72	9.96	-13.63	1	4	0	47	307.397	5	↓ MOL2 SDF SMILES Flexibase

65155847

Analogs

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Popular Name: 2-(1-ethylpyrrolo[2,3-b]pyridin-3-yl)-N-(p-tolylmethyl)acetamide 2-(1-ethylpyrrolo[2,3-b]pyridin-…

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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)	2.77	9.85	-13.77	1	4	0	47	307.397	5	↓ MOL2 SDF SMILES Flexibase

65155852

Analogs

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Popular Name: N-benzyl-2-(1-ethylpyrrolo[2,3-b]pyridin-3-yl)-N-methyl-acetamide N-benzyl-2-(1-ethylpyrrolo[2,3-b…

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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)	2.56	11.28	-15.02	0	4	0	38	307.397	5	↓ MOL2 SDF SMILES Flexibase

65155872

Analogs

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Popular Name: 2-(1-ethylpyrrolo[2,3-b]pyridin-3-yl)-N-[(3-methoxyphenyl)methyl]acetamide 2-(1-ethylpyrrolo[2,3-b]pyridin-…

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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)	2.35	8.47	-15.34	1	5	0	56	323.396	6	↓ MOL2 SDF SMILES Flexibase

65155881

Analogs

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Popular Name: 2-(1-ethylpyrrolo[2,3-b]pyridin-3-yl)-N-[(1S)-1-(4-fluorophenyl)ethyl]acetamide 2-(1-ethylpyrrolo[2,3-b]pyridin-…

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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)	3.04	10.07	-15.11	1	4	0	47	325.387	5	↓ MOL2 SDF SMILES Flexibase

65155882

Analogs

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Popular Name: 2-(1-ethylpyrrolo[2,3-b]pyridin-3-yl)-N-[(1R)-1-(4-fluorophenyl)ethyl]acetamide 2-(1-ethylpyrrolo[2,3-b]pyridin-…

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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)	3.04	10.07	-14.96	1	4	0	47	325.387	5	↓ MOL2 SDF SMILES Flexibase

65155896

Analogs

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Popular Name: 2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)-N-(m-tolylmethyl)acetamide 2-(1-methylpyrrolo[2,3-b]pyridin…

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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)	2.37	8.92	-14.13	1	4	0	47	293.37	4	↓ MOL2 SDF SMILES Flexibase

65155898

Analogs

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Popular Name: N-[(3-fluorophenyl)methyl]-2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)acetamide N-[(3-fluorophenyl)methyl]-2-(1-…

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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)	2.08	8.32	-15.08	1	4	0	47	297.333	4	↓ MOL2 SDF SMILES Flexibase

65155907

Analogs

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Popular Name: N-[(2-methoxyphenyl)methyl]-2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)acetamide N-[(2-methoxyphenyl)methyl]-2-(1…

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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)	1.95	7.59	-15.63	1	5	0	56	309.369	5	↓ MOL2 SDF SMILES Flexibase

65155917

Analogs

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Popular Name: N-[(2,3-dimethoxyphenyl)methyl]-2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)acetamide N-[(2,3-dimethoxyphenyl)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)	1.76	7.49	-16.61	1	6	0	65	339.395	6	↓ MOL2 SDF SMILES Flexibase

65155920

Analogs

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Popular Name: N-[(2,5-difluorophenyl)methyl]-2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)acetamide N-[(2,5-difluorophenyl)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)	2.19	8.34	-14.83	1	4	0	47	315.323	4	↓ MOL2 SDF SMILES Flexibase

65155928

Analogs

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Popular Name: N-benzyl-2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)acetamide N-benzyl-2-(1-methylpyrrolo[2,3-…

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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)	1.94	8.26	-14.1	1	4	0	47	279.343	4	↓ MOL2 SDF SMILES Flexibase

65155934

Analogs

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Popular Name: 2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)-N-[(1S)-1-phenylethyl]acetamide 2-(1-methylpyrrolo[2,3-b]pyridin…

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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)	2.50	9.09	-14.72	1	4	0	47	293.37	4	↓ MOL2 SDF SMILES Flexibase

65155936

Analogs

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Popular Name: 2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)-N-[(1R)-1-phenylethyl]acetamide 2-(1-methylpyrrolo[2,3-b]pyridin…

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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)	2.50	9.09	-14.56	1	4	0	47	293.37	4	↓ MOL2 SDF SMILES Flexibase

65155945

Analogs

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Popular Name: N-benzyl-N-ethyl-2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)acetamide N-benzyl-N-ethyl-2-(1-methylpyrr…

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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)	2.56	11.27	-14.87	0	4	0	38	307.397	5	↓ MOL2 SDF SMILES Flexibase

65155949

Analogs

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Popular Name: N-[(4-chlorophenyl)methyl]-2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)acetamide N-[(4-chlorophenyl)methyl]-2-(1-…

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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)	2.62	8.78	-14.22	1	4	0	47	313.788	4	↓ MOL2 SDF SMILES Flexibase

65155950

Analogs

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Popular Name: N-[(4-fluorophenyl)methyl]-2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)acetamide N-[(4-fluorophenyl)methyl]-2-(1-…

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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)	2.10	8.32	-14.75	1	4	0	47	297.333	4	↓ MOL2 SDF SMILES Flexibase

65155951

Analogs

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Popular Name: N-[(4-methoxyphenyl)methyl]-2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)acetamide N-[(4-methoxyphenyl)methyl]-2-(1…

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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)	2.00	7.56	-15.33	1	5	0	56	309.369	5	↓ MOL2 SDF SMILES Flexibase

65155953

Analogs

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Popular Name: N-[(2-fluorophenyl)methyl]-2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)acetamide N-[(2-fluorophenyl)methyl]-2-(1-…

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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)	2.06	8.28	-15.49	1	4	0	47	297.333	4	↓ MOL2 SDF SMILES Flexibase

65155955

Analogs

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Popular Name: N-[(2,4-difluorophenyl)methyl]-2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)acetamide N-[(2,4-difluorophenyl)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)	2.19	8.34	-15.24	1	4	0	47	315.323	4	↓ MOL2 SDF SMILES Flexibase

65155959

Analogs

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Popular Name: N-[(3,5-difluorophenyl)methyl]-2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)acetamide N-[(3,5-difluorophenyl)methyl]-2…

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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)	2.19	8.39	-14.44	1	4	0	47	315.323	4	↓ MOL2 SDF SMILES Flexibase

65155961

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Popular Name: N-[(3-chloro-4-fluoro-phenyl)methyl]-2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)acetamide N-[(3-chloro-4-fluoro-phenyl)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)	2.71	8.82	-15.64	1	4	0	47	331.778	4	↓ MOL2 SDF SMILES Flexibase

65155962

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Popular Name: N-[(2-chloro-4-fluoro-phenyl)methyl]-2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)acetamide N-[(2-chloro-4-fluoro-phenyl)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)	2.71	8.74	-14.55	1	4	0	47	331.778	4	↓ MOL2 SDF SMILES Flexibase

65155965

Analogs

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Popular Name: 2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)-N-[[3-(trifluoromethyl)phenyl]methyl]acetamide 2-(1-methylpyrrolo[2,3-b]pyridin…

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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)	2.81	9.28	-15.43	1	4	0	47	347.34	5	↓ MOL2 SDF SMILES Flexibase

65155966

Analogs

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Popular Name: 2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)-N-(o-tolylmethyl)acetamide 2-(1-methylpyrrolo[2,3-b]pyridin…

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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)	2.34	9.05	-14.02	1	4	0	47	293.37	4	↓ MOL2 SDF SMILES Flexibase

65155967

Analogs

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Popular Name: 2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)-N-(p-tolylmethyl)acetamide 2-(1-methylpyrrolo[2,3-b]pyridin…

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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)	2.39	8.93	-14.15	1	4	0	47	293.37	4	↓ MOL2 SDF SMILES Flexibase

65155970

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Popular Name: N-[(3-chlorophenyl)methyl]-2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)acetamide N-[(3-chlorophenyl)methyl]-2-(1-…

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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)	2.59	8.77	-14.48	1	4	0	47	313.788	4	↓ MOL2 SDF SMILES Flexibase

65155971

Analogs

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Popular Name: N-[(2-chlorophenyl)methyl]-2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)acetamide N-[(2-chlorophenyl)methyl]-2-(1-…

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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)	2.57	8.67	-14.57	1	4	0	47	313.788	4	↓ MOL2 SDF SMILES Flexibase

65155974

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Popular Name: N-[(2,4-dimethoxyphenyl)methyl]-2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)acetamide N-[(2,4-dimethoxyphenyl)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)	1.98	6.88	-16.53	1	6	0	65	339.395	6	↓ MOL2 SDF SMILES Flexibase

65155976

Analogs

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Popular Name: N-benzyl-N-methyl-2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)acetamide N-benzyl-N-methyl-2-(1-methylpyr…

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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)	2.19	10.36	-15.3	0	4	0	38	293.37	4	↓ MOL2 SDF SMILES Flexibase

65155981

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Popular Name: N-[(3,4-dimethoxyphenyl)methyl]-2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)acetamide N-[(3,4-dimethoxyphenyl)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)	1.59	7.45	-17.66	1	6	0	65	339.395	6	↓ MOL2 SDF SMILES Flexibase

65155987

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Popular Name: N-[(3-methoxyphenyl)methyl]-2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)acetamide N-[(3-methoxyphenyl)methyl]-2-(1…

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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)	1.97	7.55	-15.61	1	5	0	56	309.369	5	↓ MOL2 SDF SMILES Flexibase

65155991

Analogs

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Popular Name: N-[(4-bromophenyl)methyl]-2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)acetamide N-[(4-bromophenyl)methyl]-2-(1-m…

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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)	2.75	8.88	-14.16	1	4	0	47	358.239	4	↓ MOL2 SDF SMILES Flexibase

65155997

Analogs

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Popular Name: N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)acetamide N-[(1S)-1-(4-methoxyphenyl)ethyl…

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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)	2.56	8.39	-15.81	1	5	0	56	323.396	5	↓ MOL2 SDF SMILES Flexibase

65155999

Analogs

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Popular Name: N-[(1R)-1-(4-methoxyphenyl)ethyl]-2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)acetamide N-[(1R)-1-(4-methoxyphenyl)ethyl…

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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)	2.56	8.38	-15.66	1	5	0	56	323.396	5	↓ MOL2 SDF SMILES Flexibase

65156000

Analogs

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Popular Name: N-[(1S)-1-(3,4-dimethoxyphenyl)ethyl]-2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)acetamide N-[(1S)-1-(3,4-dimethoxyphenyl)e…

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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)	2.15	8.3	-18.67	1	6	0	65	353.422	6	↓ MOL2 SDF SMILES Flexibase

65156002

Analogs

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Popular Name: N-[(1R)-1-(3,4-dimethoxyphenyl)ethyl]-2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)acetamide N-[(1R)-1-(3,4-dimethoxyphenyl)e…

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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)	2.15	8.29	-18.49	1	6	0	65	353.422	6	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

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Structural Results Found: (before additional filtering)

SQL Query Was

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