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ZINC Item

Suppliers, Protomers, & Similar Substances

52874817

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: dimethyl dimethyl

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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)	3.99	8.41	-12.66	2	7	0	94	384.432	11	↓ MOL2 SDF SMILES Flexibase

52896144

Analogs

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Popular Name: methyl 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)	3.87	7.78	-14.15	2	5	0	67	326.396	9	↓ MOL2 SDF SMILES Flexibase

20245408

Analogs

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Popular Name: 2-[dimethylsulfamoyl-(4-fluorophenyl)amino]-N-[(1S)-1-methyl-3-phenyl-propyl]acetamide 2-[dimethylsulfamoyl-(4-fluoroph…

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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)	3.84	7.76	-20.36	1	6	0	70	407.511	9	↓ MOL2 SDF SMILES Flexibase

20245410

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[dimethylsulfamoyl-(4-fluorophenyl)amino]-N-[(1R)-1-methyl-3-phenyl-propyl]acetamide 2-[dimethylsulfamoyl-(4-fluoroph…

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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)	3.84	7.88	-12.28	1	6	0	70	407.511	9	↓ MOL2 SDF SMILES Flexibase

22361637

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[3-(2-chlorophenyl)propyl]-2-[(4-ethylphenyl)-methylsulfonyl-amino]acetamide N-[3-(2-chlorophenyl)propyl]-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)	4.89	8.54	-25.73	1	5	0	66	408.951	9	↓ MOL2 SDF SMILES Flexibase

22361639

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[3-(4-chlorophenyl)propyl]-2-[(4-ethylphenyl)-methylsulfonyl-amino]acetamide N-[3-(4-chlorophenyl)propyl]-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)	4.94	8.62	-24.97	1	5	0	66	408.951	9	↓ MOL2 SDF SMILES Flexibase

22361641

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(4-ethylphenyl)-methylsulfonyl-amino]-N-[3-(4-fluorophenyl)propyl]acetamide 2-[(4-ethylphenyl)-methylsulfony…

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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)	4.42	8.17	-25.67	1	5	0	66	392.496	9	↓ MOL2 SDF SMILES Flexibase

22361643

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(4-ethylphenyl)-methylsulfonyl-amino]-N-[3-(2-methoxyphenyl)propyl]acetamide 2-[(4-ethylphenyl)-methylsulfony…

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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)	4.27	7.48	-26.1	1	6	0	76	404.532	10	↓ MOL2 SDF SMILES Flexibase

22361645

Analogs

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Popular Name: 2-[(4-ethylphenyl)-methylsulfonyl-amino]-N-[3-(3-methoxyphenyl)propyl]acetamide 2-[(4-ethylphenyl)-methylsulfony…

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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)	4.29	7.43	-26.52	1	6	0	76	404.532	10	↓ MOL2 SDF SMILES Flexibase

22361647

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(4-ethylphenyl)-methylsulfonyl-amino]-N-[3-(4-methoxyphenyl)propyl]acetamide 2-[(4-ethylphenyl)-methylsulfony…

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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)	4.32	7.42	-26.29	1	6	0	76	404.532	10	↓ MOL2 SDF SMILES Flexibase

22361653

Analogs

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Popular Name: 2-[(4-ethylphenyl)-methylsulfonyl-amino]-N-[3-(3-isopropoxyphenyl)propyl]acetamide 2-[(4-ethylphenyl)-methylsulfony…

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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)	5.03	8.98	-26.06	1	6	0	76	432.586	11	↓ MOL2 SDF SMILES Flexibase

22361656

Analogs

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Popular Name: 2-[(4-ethylphenyl)-methylsulfonyl-amino]-N-[3-(4-isopropoxyphenyl)propyl]acetamide 2-[(4-ethylphenyl)-methylsulfony…

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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)	5.05	9.02	-25.66	1	6	0	76	432.586	11	↓ MOL2 SDF SMILES Flexibase

22361707

Analogs

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Popular Name: N-[3-(4-ethoxyphenyl)propyl]-2-[(4-ethylphenyl)-methylsulfonyl-amino]acetamide N-[3-(4-ethoxyphenyl)propyl]-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)	4.69	8.35	-26.48	1	6	0	76	418.559	11	↓ MOL2 SDF SMILES Flexibase

22361709

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(4-ethylphenyl)-methylsulfonyl-amino]-N-[3-(2-propoxyphenyl)propyl]acetamide 2-[(4-ethylphenyl)-methylsulfony…

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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)	5.15	9.2	-25.63	1	6	0	76	432.586	12	↓ MOL2 SDF SMILES Flexibase

22361711

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[3-(3,4-dimethoxyphenyl)propyl]-2-[(4-ethylphenyl)-methylsulfonyl-amino]acetamide N-[3-(3,4-dimethoxyphenyl)propyl…

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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)	3.91	7.33	-28.77	1	7	0	85	434.558	11	↓ MOL2 SDF SMILES Flexibase

22361713

Analogs

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Popular Name: N-[(2R)-2-benzylbutyl]-2-[(4-ethylphenyl)-methylsulfonyl-amino]acetamide N-[(2R)-2-benzylbutyl]-2-[(4-eth…

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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)	4.99	9.12	-24.28	1	5	0	66	402.56	10	↓ MOL2 SDF SMILES Flexibase

22361715

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2S)-2-benzylbutyl]-2-[(4-ethylphenyl)-methylsulfonyl-amino]acetamide N-[(2S)-2-benzylbutyl]-2-[(4-eth…

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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)	4.99	9.33	-24.79	1	5	0	66	402.56	10	↓ MOL2 SDF SMILES Flexibase

22361743

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S)-1,3-dimethyl-3-phenyl-butyl]-2-[(4-ethylphenyl)-methylsulfonyl-amino]acetamide N-[(1S)-1,3-dimethyl-3-phenyl-bu…

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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)	5.31	10.45	-24.22	1	5	0	66	416.587	9	↓ MOL2 SDF SMILES Flexibase

22361745

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R)-1,3-dimethyl-3-phenyl-butyl]-2-[(4-ethylphenyl)-methylsulfonyl-amino]acetamide N-[(1R)-1,3-dimethyl-3-phenyl-bu…

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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)	5.31	10.48	-23.33	1	5	0	66	416.587	9	↓ MOL2 SDF SMILES Flexibase

22361833

Analogs

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Popular Name: N-[3-(2-chlorophenyl)propyl]-2-[(2,5-dichlorophenyl)-methylsulfonyl-amino]acetamide N-[3-(2-chlorophenyl)propyl]-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)	5.26	8.26	-12.64	1	5	0	66	449.787	8	↓ MOL2 SDF SMILES Flexibase

22361835

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[3-(4-chlorophenyl)propyl]-2-[(2,5-dichlorophenyl)-methylsulfonyl-amino]acetamide N-[3-(4-chlorophenyl)propyl]-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)	5.31	8.36	-12.76	1	5	0	66	449.787	8	↓ MOL2 SDF SMILES Flexibase

22361837

Analogs

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Popular Name: 2-[(2,5-dichlorophenyl)-methylsulfonyl-amino]-N-[3-(4-fluorophenyl)propyl]acetamide 2-[(2,5-dichlorophenyl)-methylsu…

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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	7.9	-13.45	1	5	0	66	433.332	8	↓ MOL2 SDF SMILES Flexibase

22361839

Analogs

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Popular Name: 2-[(2,5-dichlorophenyl)-methylsulfonyl-amino]-N-[3-(2-methoxyphenyl)propyl]acetamide 2-[(2,5-dichlorophenyl)-methylsu…

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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)	4.64	7.21	-13.4	1	6	0	76	445.368	9	↓ MOL2 SDF SMILES Flexibase

22361841

Analogs

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Popular Name: 2-[(2,5-dichlorophenyl)-methylsulfonyl-amino]-N-[3-(3-methoxyphenyl)propyl]acetamide 2-[(2,5-dichlorophenyl)-methylsu…

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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)	4.66	7.14	-14.06	1	6	0	76	445.368	9	↓ MOL2 SDF SMILES Flexibase

22361843

Analogs

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Popular Name: 2-[(2,5-dichlorophenyl)-methylsulfonyl-amino]-N-[3-(4-methoxyphenyl)propyl]acetamide 2-[(2,5-dichlorophenyl)-methylsu…

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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	7.16	-13.82	1	6	0	76	445.368	9	↓ MOL2 SDF SMILES Flexibase

22361849

Analogs

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Popular Name: 2-[(2,5-dichlorophenyl)-methylsulfonyl-amino]-N-[3-(3-isopropoxyphenyl)propyl]acetamide 2-[(2,5-dichlorophenyl)-methylsu…

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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)	5.40	8.75	-13.49	1	6	0	76	473.422	10	↓ MOL2 SDF SMILES Flexibase

22361851

Analogs

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Popular Name: 2-[(2,5-dichlorophenyl)-methylsulfonyl-amino]-N-[3-(4-isopropoxyphenyl)propyl]acetamide 2-[(2,5-dichlorophenyl)-methylsu…

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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)	5.42	8.71	-13.65	1	6	0	76	473.422	10	↓ MOL2 SDF SMILES Flexibase

22361907

Analogs

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Popular Name: 2-[(2,5-dichlorophenyl)-methylsulfonyl-amino]-N-[3-(4-ethoxyphenyl)propyl]acetamide 2-[(2,5-dichlorophenyl)-methylsu…

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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	8.08	-13.69	1	6	0	76	459.395	10	↓ MOL2 SDF SMILES Flexibase

22361909

Analogs

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Popular Name: 2-[(2,5-dichlorophenyl)-methylsulfonyl-amino]-N-[3-(2-propoxyphenyl)propyl]acetamide 2-[(2,5-dichlorophenyl)-methylsu…

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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)	5.52	8.93	-12.92	1	6	0	76	473.422	11	↓ MOL2 SDF SMILES Flexibase

22361911

Analogs

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Popular Name: 2-[(2,5-dichlorophenyl)-methylsulfonyl-amino]-N-[3-(3,4-dimethoxyphenyl)propyl]acetamide 2-[(2,5-dichlorophenyl)-methylsu…

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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)	4.28	7.07	-16.57	1	7	0	85	475.394	10	↓ MOL2 SDF SMILES Flexibase

22361914

Analogs

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Popular Name: N-[(2R)-2-benzylbutyl]-2-[(2,5-dichlorophenyl)-methylsulfonyl-amino]acetamide N-[(2R)-2-benzylbutyl]-2-[(2,5-d…

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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)	5.36	8.89	-11.4	1	5	0	66	443.396	9	↓ MOL2 SDF SMILES Flexibase

22361916

Analogs

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Popular Name: N-[(2S)-2-benzylbutyl]-2-[(2,5-dichlorophenyl)-methylsulfonyl-amino]acetamide N-[(2S)-2-benzylbutyl]-2-[(2,5-d…

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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)	5.36	8.77	-21.09	1	5	0	66	443.396	9	↓ MOL2 SDF SMILES Flexibase

22361947

Analogs

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Popular Name: 2-[(2,5-dichlorophenyl)-methylsulfonyl-amino]-N-[(1S)-1,3-dimethyl-3-phenyl-butyl]acetamide 2-[(2,5-dichlorophenyl)-methylsu…

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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)	5.68	10.21	-11.47	1	5	0	66	457.423	8	↓ MOL2 SDF SMILES Flexibase

22361949

Analogs

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Popular Name: 2-[(2,5-dichlorophenyl)-methylsulfonyl-amino]-N-[(1R)-1,3-dimethyl-3-phenyl-butyl]acetamide 2-[(2,5-dichlorophenyl)-methylsu…

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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)	5.68	10.18	-11.69	1	5	0	66	457.423	8	↓ MOL2 SDF SMILES Flexibase

22362575

Analogs

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Popular Name: N-[3-(2-chlorophenyl)propyl]-2-[(2-methoxyphenyl)-methylsulfonyl-amino]acetamide N-[3-(2-chlorophenyl)propyl]-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)	3.98	6.48	-22.66	1	6	0	76	410.923	9	↓ MOL2 SDF SMILES Flexibase

22362577

Analogs

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Popular Name: N-[3-(4-chlorophenyl)propyl]-2-[(2-methoxyphenyl)-methylsulfonyl-amino]acetamide N-[3-(4-chlorophenyl)propyl]-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)	4.03	6.58	-22.26	1	6	0	76	410.923	9	↓ MOL2 SDF SMILES Flexibase

22362579

Analogs

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Popular Name: N-[3-(4-fluorophenyl)propyl]-2-[(2-methoxyphenyl)-methylsulfonyl-amino]acetamide N-[3-(4-fluorophenyl)propyl]-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)	3.52	6.12	-22.91	1	6	0	76	394.468	9	↓ MOL2 SDF SMILES Flexibase

22362582

Analogs

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Popular Name: 2-[(2-methoxyphenyl)-methylsulfonyl-amino]-N-[3-(2-methoxyphenyl)propyl]acetamide 2-[(2-methoxyphenyl)-methylsulfo…

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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)	3.36	5.44	-23.57	1	7	0	85	406.504	10	↓ MOL2 SDF SMILES Flexibase

22362584

Analogs

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Popular Name: 2-[(2-methoxyphenyl)-methylsulfonyl-amino]-N-[3-(3-methoxyphenyl)propyl]acetamide 2-[(2-methoxyphenyl)-methylsulfo…

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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)	3.39	5.37	-23.74	1	7	0	85	406.504	10	↓ MOL2 SDF SMILES Flexibase

22362586

Analogs

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Popular Name: 2-[(2-methoxyphenyl)-methylsulfonyl-amino]-N-[3-(4-methoxyphenyl)propyl]acetamide 2-[(2-methoxyphenyl)-methylsulfo…

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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)	3.41	5.37	-23.57	1	7	0	85	406.504	10	↓ MOL2 SDF SMILES Flexibase

22362592

Analogs

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Popular Name: N-[3-(3-isopropoxyphenyl)propyl]-2-[(2-methoxyphenyl)-methylsulfonyl-amino]acetamide N-[3-(3-isopropoxyphenyl)propyl]…

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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)	4.13	8.18	-14.67	1	7	0	85	434.558	11	↓ MOL2 SDF SMILES Flexibase

22362594

Analogs

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Popular Name: N-[3-(4-isopropoxyphenyl)propyl]-2-[(2-methoxyphenyl)-methylsulfonyl-amino]acetamide N-[3-(4-isopropoxyphenyl)propyl]…

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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)	4.15	6.91	-23.21	1	7	0	85	434.558	11	↓ MOL2 SDF SMILES Flexibase

22362648

Analogs

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Popular Name: N-[3-(4-ethoxyphenyl)propyl]-2-[(2-methoxyphenyl)-methylsulfonyl-amino]acetamide N-[3-(4-ethoxyphenyl)propyl]-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)	3.79	7.58	-14.75	1	7	0	85	420.531	11	↓ MOL2 SDF SMILES Flexibase

22362650

Analogs

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Popular Name: 2-[(2-methoxyphenyl)-methylsulfonyl-amino]-N-[3-(2-propoxyphenyl)propyl]acetamide 2-[(2-methoxyphenyl)-methylsulfo…

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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)	4.24	7.16	-23.1	1	7	0	85	434.558	12	↓ MOL2 SDF SMILES Flexibase

22362652

Analogs

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Popular Name: N-[3-(3,4-dimethoxyphenyl)propyl]-2-[(2-methoxyphenyl)-methylsulfonyl-amino]acetamide N-[3-(3,4-dimethoxyphenyl)propyl…

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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	5.29	-26.11	1	8	0	94	436.53	11	↓ MOL2 SDF SMILES Flexibase

22362654

Analogs

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Popular Name: N-[(2R)-2-benzylbutyl]-2-[(2-methoxyphenyl)-methylsulfonyl-amino]acetamide N-[(2R)-2-benzylbutyl]-2-[(2-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)	4.08	7.07	-21.32	1	6	0	76	404.532	10	↓ MOL2 SDF SMILES Flexibase

22362656

Analogs

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Popular Name: N-[(2S)-2-benzylbutyl]-2-[(2-methoxyphenyl)-methylsulfonyl-amino]acetamide N-[(2S)-2-benzylbutyl]-2-[(2-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)	4.08	8.56	-13.12	1	6	0	76	404.532	10	↓ MOL2 SDF SMILES Flexibase

22362686

Analogs

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Popular Name: N-[(1S)-1,3-dimethyl-3-phenyl-butyl]-2-[(2-methoxyphenyl)-methylsulfonyl-amino]acetamide N-[(1S)-1,3-dimethyl-3-phenyl-bu…

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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)	4.41	8.46	-20.97	1	6	0	76	418.559	9	↓ MOL2 SDF SMILES Flexibase

22362688

Analogs

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Popular Name: N-[(1R)-1,3-dimethyl-3-phenyl-butyl]-2-[(2-methoxyphenyl)-methylsulfonyl-amino]acetamide N-[(1R)-1,3-dimethyl-3-phenyl-bu…

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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)	4.41	9.67	-12.66	1	6	0	76	418.559	9	↓ MOL2 SDF SMILES Flexibase

22363201

Analogs

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Popular Name: N-[3-(2-chlorophenyl)propyl]-2-[(3-fluorophenyl)-methylsulfonyl-amino]acetamide N-[3-(2-chlorophenyl)propyl]-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)	4.11	6.89	-23.43	1	5	0	66	398.887	8	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

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filter.purchasability = annotated
page.format = targets
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Structural Results Found: (before additional filtering)

SQL Query Was

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<script type="text/javascript" src="//zinc12.docking.org/js/embed.js"></script>
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