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ZINC Item

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65163419

Analogs

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Popular Name: N-[2-(1-ethylpyrrolo[2,3-b]pyridin-3-yl)ethyl]-3-methoxy-benzamide N-[2-(1-ethylpyrrolo[2,3-b]pyrid…

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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)	2.66	8.56	-17.98	1	5	0	56	323.396	6	↓ MOL2 SDF SMILES Flexibase

65163441

Analogs

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Popular Name: N-[2-(1-ethylpyrrolo[2,3-b]pyridin-3-yl)ethyl]-2-methoxy-benzamide N-[2-(1-ethylpyrrolo[2,3-b]pyrid…

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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)	3.19	9.82	-18.34	1	5	0	56	323.396	6	↓ MOL2 SDF SMILES Flexibase

65163443

Analogs

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Popular Name: 2-chloro-N-[2-(1-ethylpyrrolo[2,3-b]pyridin-3-yl)ethyl]-6-fluoro-benzamide 2-chloro-N-[2-(1-ethylpyrrolo[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)	3.38	9.6	-16.13	1	4	0	47	345.805	5	↓ MOL2 SDF SMILES Flexibase

65163463

Analogs

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Popular Name: N-[2-(1-ethylpyrrolo[2,3-b]pyridin-3-yl)ethyl]-2-(trifluoromethyl)benzamide N-[2-(1-ethylpyrrolo[2,3-b]pyrid…

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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)	3.48	10.3	-19.19	1	4	0	47	361.367	6	↓ MOL2 SDF SMILES Flexibase

65163468

Analogs

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Popular Name: N-[2-(1-ethylpyrrolo[2,3-b]pyridin-3-yl)ethyl]-2-fluoro-benzamide N-[2-(1-ethylpyrrolo[2,3-b]pyrid…

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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	9.33	-19.38	1	4	0	47	311.36	5	↓ MOL2 SDF SMILES Flexibase

65163470

Analogs

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Popular Name: N-[2-(1-ethylpyrrolo[2,3-b]pyridin-3-yl)ethyl]-4-fluoro-benzamide N-[2-(1-ethylpyrrolo[2,3-b]pyrid…

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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)	2.79	9.33	-14.77	1	4	0	47	311.36	5	↓ MOL2 SDF SMILES Flexibase

65163472

Analogs

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Popular Name: 4-cyano-N-[2-(1-ethylpyrrolo[2,3-b]pyridin-3-yl)ethyl]benzamide 4-cyano-N-[2-(1-ethylpyrrolo[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)	2.38	9.65	-17.36	1	5	0	71	318.38	5	↓ MOL2 SDF SMILES Flexibase

65163473

Analogs

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Popular Name: 2-chloro-N-[2-(1-ethylpyrrolo[2,3-b]pyridin-3-yl)ethyl]-4-fluoro-benzamide 2-chloro-N-[2-(1-ethylpyrrolo[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)	3.40	9.83	-15.86	1	4	0	47	345.805	5	↓ MOL2 SDF SMILES Flexibase

65163475

Analogs

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Popular Name: 2-chloro-N-[2-(1-ethylpyrrolo[2,3-b]pyridin-3-yl)ethyl]-5-fluoro-benzamide 2-chloro-N-[2-(1-ethylpyrrolo[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)	3.40	9.84	-14.12	1	4	0	47	345.805	5	↓ MOL2 SDF SMILES Flexibase

65163477

Analogs

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Popular Name: N-[2-(1-ethylpyrrolo[2,3-b]pyridin-3-yl)ethyl]-3-fluoro-4-methoxy-benzamide N-[2-(1-ethylpyrrolo[2,3-b]pyrid…

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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)	2.78	8.64	-19.19	1	5	0	56	341.386	6	↓ MOL2 SDF SMILES Flexibase

65163479

Analogs

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Popular Name: N-[2-(1-ethylpyrrolo[2,3-b]pyridin-3-yl)ethyl]-2,4-difluoro-benzamide N-[2-(1-ethylpyrrolo[2,3-b]pyrid…

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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	9.4	-18.11	1	4	0	47	329.35	5	↓ MOL2 SDF SMILES Flexibase

65163488

Analogs

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Popular Name: N-[2-(1-ethylpyrrolo[2,3-b]pyridin-3-yl)ethyl]-2,5-difluoro-benzamide N-[2-(1-ethylpyrrolo[2,3-b]pyrid…

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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	9.4	-16.29	1	4	0	47	329.35	5	↓ MOL2 SDF SMILES Flexibase

65163492

Analogs

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Popular Name: N-[2-(1-ethylpyrrolo[2,3-b]pyridin-3-yl)ethyl]-2,6-difluoro-benzamide N-[2-(1-ethylpyrrolo[2,3-b]pyrid…

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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)	2.86	9.22	-17.23	1	4	0	47	329.35	5	↓ MOL2 SDF SMILES Flexibase

65163528

Analogs

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Popular Name: N-[2-(1-ethylpyrrolo[2,3-b]pyridin-3-yl)ethyl]benzamide N-[2-(1-ethylpyrrolo[2,3-b]pyrid…

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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)	2.63	9.26	-15.31	1	4	0	47	293.37	5	↓ MOL2 SDF SMILES Flexibase

65163530

Analogs

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Popular Name: 2-chloro-N-[2-(1-ethylpyrrolo[2,3-b]pyridin-3-yl)ethyl]benzamide 2-chloro-N-[2-(1-ethylpyrrolo[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)	3.26	9.77	-16.67	1	4	0	47	327.815	5	↓ MOL2 SDF SMILES Flexibase

65163548

Analogs

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Popular Name: N-[2-(1-ethylpyrrolo[2,3-b]pyridin-3-yl)ethyl]-4-methoxy-benzamide N-[2-(1-ethylpyrrolo[2,3-b]pyrid…

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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)	2.69	8.57	-15.58	1	5	0	56	323.396	6	↓ MOL2 SDF SMILES Flexibase

65163553

Analogs

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Popular Name: 3-methoxy-N-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)ethyl]benzamide 3-methoxy-N-[2-(1-methylpyrrolo[…

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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)	2.29	7.64	-18.25	1	5	0	56	309.369	5	↓ MOL2 SDF SMILES Flexibase

65163554

Analogs

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Popular Name: 4-chloro-N-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)ethyl]benzamide 4-chloro-N-[2-(1-methylpyrrolo[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)	2.93	8.86	-14.64	1	4	0	47	313.788	4	↓ MOL2 SDF SMILES Flexibase

65163559

Analogs

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Popular Name: 2-bromo-N-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)ethyl]benzamide 2-bromo-N-[2-(1-methylpyrrolo[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)	3.02	8.96	-16.38	1	4	0	47	358.239	4	↓ MOL2 SDF SMILES Flexibase

65163561

Analogs

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Popular Name: 2,5-dimethyl-N-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)ethyl]benzamide 2,5-dimethyl-N-[2-(1-methylpyrro…

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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)	3.08	9.69	-14.07	1	4	0	47	307.397	4	↓ MOL2 SDF SMILES Flexibase

65163564

Analogs

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Popular Name: 2-ethoxy-N-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)ethyl]benzamide 2-ethoxy-N-[2-(1-methylpyrrolo[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)	3.19	9.82	-18.59	1	5	0	56	323.396	6	↓ MOL2 SDF SMILES Flexibase

65163570

Analogs

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Popular Name: 2-chloro-N-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)ethyl]-5-methylsulfanyl-benzamide 2-chloro-N-[2-(1-methylpyrrolo[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)	3.29	9.88	-15.01	1	4	0	47	359.882	5	↓ MOL2 SDF SMILES Flexibase

65163592

Analogs

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Popular Name: 2-methoxy-N-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)ethyl]benzamide 2-methoxy-N-[2-(1-methylpyrrolo[…

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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	8.9	-18.55	1	5	0	56	309.369	5	↓ MOL2 SDF SMILES Flexibase

65163593

Analogs

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Popular Name: 2-chloro-6-fluoro-N-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)ethyl]benzamide 2-chloro-6-fluoro-N-[2-(1-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)	3.00	8.68	-16.35	1	4	0	47	331.778	4	↓ MOL2 SDF SMILES Flexibase

65163613

Analogs

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Popular Name: 3-chloro-N-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)ethyl]benzamide 3-chloro-N-[2-(1-methylpyrrolo[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)	2.91	8.85	-16.62	1	4	0	47	313.788	4	↓ MOL2 SDF SMILES Flexibase

65163619

Analogs

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Popular Name: N-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)ethyl]-2-(trifluoromethyl)benzamide N-[2-(1-methylpyrrolo[2,3-b]pyri…

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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)	3.10	9.39	-19.36	1	4	0	47	347.34	5	↓ MOL2 SDF SMILES Flexibase

65163623

Analogs

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Popular Name: 3,4-difluoro-N-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)ethyl]benzamide 3,4-difluoro-N-[2-(1-methylpyrro…

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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)	2.51	8.46	-17.62	1	4	0	47	315.323	4	↓ MOL2 SDF SMILES Flexibase

65163630

Analogs

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Popular Name: 2-fluoro-N-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)ethyl]benzamide 2-fluoro-N-[2-(1-methylpyrrolo[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)	2.37	8.42	-19.59	1	4	0	47	297.333	4	↓ MOL2 SDF SMILES Flexibase

65163633

Analogs

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Popular Name: 4-fluoro-N-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)ethyl]benzamide 4-fluoro-N-[2-(1-methylpyrrolo[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)	2.42	8.41	-15.02	1	4	0	47	297.333	4	↓ MOL2 SDF SMILES Flexibase

65163635

Analogs

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Popular Name: 4-cyano-N-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)ethyl]benzamide 4-cyano-N-[2-(1-methylpyrrolo[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)	2.01	8.73	-17.58	1	5	0	71	304.353	4	↓ MOL2 SDF SMILES Flexibase

65163637

Analogs

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Popular Name: 3,5-difluoro-N-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)ethyl]benzamide 3,5-difluoro-N-[2-(1-methylpyrro…

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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)	2.51	8.48	-13.96	1	4	0	47	315.323	4	↓ MOL2 SDF SMILES Flexibase

65163639

Analogs

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Popular Name: 2,4-dimethyl-N-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)ethyl]benzamide 2,4-dimethyl-N-[2-(1-methylpyrro…

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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)	3.08	9.69	-14.32	1	4	0	47	307.397	4	↓ MOL2 SDF SMILES Flexibase

65163641

Analogs

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Popular Name: 4-ethoxy-N-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)ethyl]benzamide 4-ethoxy-N-[2-(1-methylpyrrolo[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)	2.69	8.59	-15.57	1	5	0	56	323.396	6	↓ MOL2 SDF SMILES Flexibase

65163643

Analogs

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Popular Name: 2-chloro-5-fluoro-N-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)ethyl]benzamide 2-chloro-5-fluoro-N-[2-(1-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)	3.02	8.92	-14.38	1	4	0	47	331.778	4	↓ MOL2 SDF SMILES Flexibase

65163645

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Popular Name: 5-chloro-2-fluoro-N-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)ethyl]benzamide 5-chloro-2-fluoro-N-[2-(1-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)	3.02	8.94	-16.31	1	4	0	47	331.778	4	↓ MOL2 SDF SMILES Flexibase

65163647

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Popular Name: 3-fluoro-4-methoxy-N-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)ethyl]benzamide 3-fluoro-4-methoxy-N-[2-(1-methy…

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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)	2.40	7.72	-19.53	1	5	0	56	327.359	5	↓ MOL2 SDF SMILES Flexibase

65163649

Analogs

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Popular Name: 2,4-difluoro-N-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)ethyl]benzamide 2,4-difluoro-N-[2-(1-methylpyrro…

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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)	2.51	8.49	-18.3	1	4	0	47	315.323	4	↓ MOL2 SDF SMILES Flexibase

65163657

Analogs

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Popular Name: 2,5-difluoro-N-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)ethyl]benzamide 2,5-difluoro-N-[2-(1-methylpyrro…

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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)	2.51	8.49	-16.52	1	4	0	47	315.323	4	↓ MOL2 SDF SMILES Flexibase

65163659

Analogs

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Popular Name: 3,5-dimethoxy-N-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)ethyl]benzamide 3,5-dimethoxy-N-[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)	2.29	6.95	-16.76	1	6	0	65	339.395	6	↓ MOL2 SDF SMILES Flexibase

65163666

Analogs

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Popular Name: 3-fluoro-4-methyl-N-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)ethyl]benzamide 3-fluoro-4-methyl-N-[2-(1-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)	2.79	9.05	-13.72	1	4	0	47	311.36	4	↓ MOL2 SDF SMILES Flexibase

65163722

Analogs

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Popular Name: N-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)ethyl]benzamide N-[2-(1-methylpyrrolo[2,3-b]pyri…

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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)	2.25	8.34	-15.54	1	4	0	47	279.343	4	↓ MOL2 SDF SMILES Flexibase

65163724

Analogs

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Popular Name: 2-chloro-N-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)ethyl]benzamide 2-chloro-N-[2-(1-methylpyrrolo[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)	2.88	8.86	-16.88	1	4	0	47	313.788	4	↓ MOL2 SDF SMILES Flexibase

65163727

Analogs

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Popular Name: 3-fluoro-N-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)ethyl]benzamide 3-fluoro-N-[2-(1-methylpyrrolo[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)	2.39	8.41	-17.47	1	4	0	47	297.333	4	↓ MOL2 SDF SMILES Flexibase

65163745

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Popular Name: 2-methyl-N-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)ethyl]benzamide 2-methyl-N-[2-(1-methylpyrrolo[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)	2.65	9.02	-14.44	1	4	0	47	293.37	4	↓ MOL2 SDF SMILES Flexibase

65163749

Analogs

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Popular Name: 3-methyl-N-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)ethyl]benzamide 3-methyl-N-[2-(1-methylpyrrolo[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)	2.68	9.01	-15.62	1	4	0	47	293.37	4	↓ MOL2 SDF SMILES Flexibase

65163753

Analogs

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Popular Name: 4-methyl-N-[2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)ethyl]benzamide 4-methyl-N-[2-(1-methylpyrrolo[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)	2.70	9.02	-15.46	1	4	0	47	293.37	4	↓ MOL2 SDF SMILES Flexibase

65163763

Analogs

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

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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)	2.31	7.64	-15.79	1	5	0	56	309.369	5	↓ MOL2 SDF SMILES Flexibase

65163771

Analogs

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Popular Name: 3-chloro-N-[2-[1-(2-methoxyethyl)pyrrolo[2,3-b]pyridin-3-yl]ethyl]benzamide 3-chloro-N-[2-[1-(2-methoxyethyl…

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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)	2.89	8.81	-16.94	1	5	0	56	357.841	7	↓ MOL2 SDF SMILES Flexibase

65163774

Analogs

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Popular Name: 2-fluoro-N-[2-[1-(2-methoxyethyl)pyrrolo[2,3-b]pyridin-3-yl]ethyl]benzamide 2-fluoro-N-[2-[1-(2-methoxyethyl…

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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	8.37	-19.84	1	5	0	56	341.386	7	↓ MOL2 SDF SMILES Flexibase

65163776

Analogs

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Popular Name: 3,5-difluoro-N-[2-[1-(2-methoxyethyl)pyrrolo[2,3-b]pyridin-3-yl]ethyl]benzamide 3,5-difluoro-N-[2-[1-(2-methoxye…

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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)	2.49	8.43	-14.28	1	5	0	56	359.376	7	↓ MOL2 SDF SMILES Flexibase

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SQL Query Was

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