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ZINC Item

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22361428

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(4-chlorophenyl)sulfonyl-phenyl-amino]-N-[3-(3-isopropoxyphenyl)propyl]acetamide 2-[(4-chlorophenyl)sulfonyl-phen…

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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)	6.33	11.28	-22.02	1	6	0	76	501.048	11	↓ MOL2 SDF SMILES Flexibase

22361431

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(4-chlorophenyl)sulfonyl-phenyl-amino]-N-[3-(4-isopropoxyphenyl)propyl]acetamide 2-[(4-chlorophenyl)sulfonyl-phen…

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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)	6.35	11.25	-21.78	1	6	0	76	501.048	11	↓ MOL2 SDF SMILES Flexibase

22361487

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(4-chlorophenyl)sulfonyl-phenyl-amino]-N-[3-(4-ethoxyphenyl)propyl]acetamide 2-[(4-chlorophenyl)sulfonyl-phen…

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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)	5.99	10.31	-20.37	1	6	0	76	487.021	11	↓ MOL2 SDF SMILES Flexibase

22361489

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(4-chlorophenyl)sulfonyl-phenyl-amino]-N-[3-(2-propoxyphenyl)propyl]acetamide 2-[(4-chlorophenyl)sulfonyl-phen…

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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)	6.44	11.51	-21.48	1	6	0	76	501.048	12	↓ MOL2 SDF SMILES Flexibase

22361491

Analogs

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Popular Name: 2-[(4-chlorophenyl)sulfonyl-phenyl-amino]-N-[3-(3,4-dimethoxyphenyl)propyl]acetamide 2-[(4-chlorophenyl)sulfonyl-phen…

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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	9.64	-24.7	1	7	0	85	503.02	11	↓ MOL2 SDF SMILES Flexibase

22361493

Analogs

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Popular Name: N-[(2R)-2-benzylbutyl]-2-[(4-chlorophenyl)sulfonyl-phenyl-amino]acetamide N-[(2R)-2-benzylbutyl]-2-[(4-chl…

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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)	6.29	11	-18.34	1	5	0	66	471.022	10	↓ MOL2 SDF SMILES Flexibase

22361495

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2S)-2-benzylbutyl]-2-[(4-chlorophenyl)sulfonyl-phenyl-amino]acetamide N-[(2S)-2-benzylbutyl]-2-[(4-chl…

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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)	6.29	11.63	-21.15	1	5	0	66	471.022	10	↓ MOL2 SDF SMILES Flexibase

22361525

Analogs

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Popular Name: 2-[(4-chlorophenyl)sulfonyl-phenyl-amino]-N-[(1S)-1,3-dimethyl-3-phenyl-butyl]acetamide 2-[(4-chlorophenyl)sulfonyl-phen…

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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	12.37	-18.58	1	5	0	66	485.049	9	↓ MOL2 SDF SMILES Flexibase

22361527

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(4-chlorophenyl)sulfonyl-phenyl-amino]-N-[(1R)-1,3-dimethyl-3-phenyl-butyl]acetamide 2-[(4-chlorophenyl)sulfonyl-phen…

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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	12.77	-19.82	1	5	0	66	485.049	9	↓ MOL2 SDF SMILES Flexibase

22362032

Analogs

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Popular Name: 2-[(3-chlorophenyl)-(4-chlorophenyl)sulfonyl-amino]-N-[3-(2-chlorophenyl)propyl]acetamide 2-[(3-chlorophenyl)-(4-chlorophe…

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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)	6.84	11.11	-15.74	1	5	0	66	511.858	9	↓ MOL2 SDF SMILES Flexibase

22362034

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(3-chlorophenyl)-(4-chlorophenyl)sulfonyl-amino]-N-[3-(4-chlorophenyl)propyl]acetamide 2-[(3-chlorophenyl)-(4-chlorophe…

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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)	6.89	11.2	-16.08	1	5	0	66	511.858	9	↓ MOL2 SDF SMILES Flexibase

22362036

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(3-chlorophenyl)-(4-chlorophenyl)sulfonyl-amino]-N-[3-(4-fluorophenyl)propyl]acetamide 2-[(3-chlorophenyl)-(4-chlorophe…

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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)	6.37	10.75	-16.77	1	5	0	66	495.403	9	↓ MOL2 SDF SMILES Flexibase

22362038

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(3-chlorophenyl)-(4-chlorophenyl)sulfonyl-amino]-N-[3-(2-methoxyphenyl)propyl]acetamide 2-[(3-chlorophenyl)-(4-chlorophe…

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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)	6.22	10.07	-16.43	1	6	0	76	507.439	10	↓ MOL2 SDF SMILES Flexibase

22362040

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(3-chlorophenyl)-(4-chlorophenyl)sulfonyl-amino]-N-[3-(3-methoxyphenyl)propyl]acetamide 2-[(3-chlorophenyl)-(4-chlorophe…

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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)	6.24	10	-17.07	1	6	0	76	507.439	10	↓ MOL2 SDF SMILES Flexibase

22362042

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(3-chlorophenyl)-(4-chlorophenyl)sulfonyl-amino]-N-[3-(4-methoxyphenyl)propyl]acetamide 2-[(3-chlorophenyl)-(4-chlorophe…

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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)	6.27	10	-17.15	1	6	0	76	507.439	10	↓ MOL2 SDF SMILES Flexibase

22362078

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(3-chlorophenyl)-(4-chlorophenyl)sulfonyl-amino]-N-[3-(4-ethoxyphenyl)propyl]acetamide 2-[(3-chlorophenyl)-(4-chlorophe…

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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)	6.64	10.82	-19.35	1	6	0	76	521.466	11	↓ MOL2 SDF SMILES Flexibase

22362080

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2R)-2-benzylbutyl]-2-[(3-chlorophenyl)-(4-chlorophenyl)sulfonyl-amino]acetamide N-[(2R)-2-benzylbutyl]-2-[(3-chl…

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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)	6.94	11.5	-18.45	1	5	0	66	505.467	10	↓ MOL2 SDF SMILES Flexibase

22362082

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(2S)-2-benzylbutyl]-2-[(3-chlorophenyl)-(4-chlorophenyl)sulfonyl-amino]acetamide N-[(2S)-2-benzylbutyl]-2-[(3-chl…

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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)	6.94	11.71	-19.3	1	5	0	66	505.467	10	↓ MOL2 SDF SMILES Flexibase

22362094

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(3-chlorophenyl)-(4-chlorophenyl)sulfonyl-amino]-N-[(1S)-1,3-dimethyl-3-phenyl-butyl]acetamide 2-[(3-chlorophenyl)-(4-chlorophe…

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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)	7.26	12.88	-18.96	1	5	0	66	519.494	9	↓ MOL2 SDF SMILES Flexibase

22362096

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(3-chlorophenyl)-(4-chlorophenyl)sulfonyl-amino]-N-[(1R)-1,3-dimethyl-3-phenyl-butyl]acetamide 2-[(3-chlorophenyl)-(4-chlorophe…

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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)	7.26	12.88	-18.78	1	5	0	66	519.494	9	↓ MOL2 SDF SMILES Flexibase

22362131

Analogs

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Popular Name: 2-[benzenesulfonyl-(2,3-dimethylphenyl)amino]-N-[3-(2-chlorophenyl)propyl]acetamide 2-[benzenesulfonyl-(2,3-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)	6.31	11.57	-22	1	5	0	66	471.022	9	↓ MOL2 SDF SMILES Flexibase

22362133

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[benzenesulfonyl-(2,3-dimethylphenyl)amino]-N-[3-(4-chlorophenyl)propyl]acetamide 2-[benzenesulfonyl-(2,3-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)	6.36	11.66	-21.6	1	5	0	66	471.022	9	↓ MOL2 SDF SMILES Flexibase

22362135

Analogs

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Popular Name: 2-[benzenesulfonyl-(2,3-dimethylphenyl)amino]-N-[3-(4-fluorophenyl)propyl]acetamide 2-[benzenesulfonyl-(2,3-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)	5.84	11.21	-22.28	1	5	0	66	454.567	9	↓ MOL2 SDF SMILES Flexibase

22362137

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[benzenesulfonyl-(2,3-dimethylphenyl)amino]-N-[3-(2-methoxyphenyl)propyl]acetamide 2-[benzenesulfonyl-(2,3-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)	5.69	10.53	-22.83	1	6	0	76	466.603	10	↓ MOL2 SDF SMILES Flexibase

22362139

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[benzenesulfonyl-(2,3-dimethylphenyl)amino]-N-[3-(3-methoxyphenyl)propyl]acetamide 2-[benzenesulfonyl-(2,3-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)	5.71	10.46	-23.09	1	6	0	76	466.603	10	↓ MOL2 SDF SMILES Flexibase

22362141

Analogs

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Popular Name: 2-[benzenesulfonyl-(2,3-dimethylphenyl)amino]-N-[3-(4-methoxyphenyl)propyl]acetamide 2-[benzenesulfonyl-(2,3-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)	5.74	10.46	-22.9	1	6	0	76	466.603	10	↓ MOL2 SDF SMILES Flexibase

22362147

Analogs

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Popular Name: 2-[benzenesulfonyl-(2,3-dimethylphenyl)amino]-N-[3-(3-isopropoxyphenyl)propyl]acetamide 2-[benzenesulfonyl-(2,3-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)	6.45	12.36	-15.5	1	6	0	76	494.657	11	↓ MOL2 SDF SMILES Flexibase

22362149

Analogs

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Popular Name: 2-[benzenesulfonyl-(2,3-dimethylphenyl)amino]-N-[3-(4-isopropoxyphenyl)propyl]acetamide 2-[benzenesulfonyl-(2,3-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)	6.47	11.94	-22.72	1	6	0	76	494.657	11	↓ MOL2 SDF SMILES Flexibase

22362208

Analogs

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Popular Name: 2-[benzenesulfonyl-(2,3-dimethylphenyl)amino]-N-[3-(4-ethoxyphenyl)propyl]acetamide 2-[benzenesulfonyl-(2,3-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)	6.11	11.02	-22.96	1	6	0	76	480.63	11	↓ MOL2 SDF SMILES Flexibase

22362210

Analogs

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Popular Name: 2-[benzenesulfonyl-(2,3-dimethylphenyl)amino]-N-[3-(2-propoxyphenyl)propyl]acetamide 2-[benzenesulfonyl-(2,3-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)	6.57	11.89	-22.6	1	6	0	76	494.657	12	↓ MOL2 SDF SMILES Flexibase

22362212

Analogs

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Popular Name: 2-[benzenesulfonyl-(2,3-dimethylphenyl)amino]-N-[3-(3,4-dimethoxyphenyl)propyl]acetamide 2-[benzenesulfonyl-(2,3-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)	5.33	10.38	-25.41	1	7	0	85	496.629	11	↓ MOL2 SDF SMILES Flexibase

22362214

Analogs

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Popular Name: 2-[benzenesulfonyl-(2,3-dimethylphenyl)amino]-N-[(2R)-2-benzylbutyl]acetamide 2-[benzenesulfonyl-(2,3-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)	6.41	11.78	-20.81	1	5	0	66	464.631	10	↓ MOL2 SDF SMILES Flexibase

22362216

Analogs

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Popular Name: 2-[benzenesulfonyl-(2,3-dimethylphenyl)amino]-N-[(2S)-2-benzylbutyl]acetamide 2-[benzenesulfonyl-(2,3-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)	6.41	12.49	-14.13	1	5	0	66	464.631	10	↓ MOL2 SDF SMILES Flexibase

22362249

Analogs

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Popular Name: 2-[benzenesulfonyl-(2,3-dimethylphenyl)amino]-N-[(1S)-1,3-dimethyl-3-phenyl-butyl]acetamide 2-[benzenesulfonyl-(2,3-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)	6.73	13.83	-13.39	1	5	0	66	478.658	9	↓ MOL2 SDF SMILES Flexibase

22362252

Analogs

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Popular Name: 2-[benzenesulfonyl-(2,3-dimethylphenyl)amino]-N-[(1R)-1,3-dimethyl-3-phenyl-butyl]acetamide 2-[benzenesulfonyl-(2,3-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)	6.73	13.81	-13.48	1	5	0	66	478.658	9	↓ MOL2 SDF SMILES Flexibase

22362350

Analogs

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Popular Name: N-[3-(2-chlorophenyl)propyl]-2-[(2-methoxyphenyl)-(p-tolylsulfonyl)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)	5.97	11.61	-14.69	1	6	0	76	487.021	10	↓ MOL2 SDF SMILES Flexibase

22362352

Analogs

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Popular Name: N-[3-(4-chlorophenyl)propyl]-2-[(2-methoxyphenyl)-(p-tolylsulfonyl)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)	6.01	11.72	-14.93	1	6	0	76	487.021	10	↓ MOL2 SDF SMILES Flexibase

22362354

Analogs

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Popular Name: N-[3-(4-fluorophenyl)propyl]-2-[(2-methoxyphenyl)-(p-tolylsulfonyl)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)	5.50	11.27	-15.63	1	6	0	76	470.566	10	↓ MOL2 SDF SMILES Flexibase

22362356

Analogs

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Popular Name: N-[3-(2-methoxyphenyl)propyl]-2-[(2-methoxyphenyl)-(p-tolylsulfonyl)amino]acetamide N-[3-(2-methoxyphenyl)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)	5.34	10.57	-15.5	1	7	0	85	482.602	11	↓ MOL2 SDF SMILES Flexibase

22362358

Analogs

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Popular Name: N-[3-(3-methoxyphenyl)propyl]-2-[(2-methoxyphenyl)-(p-tolylsulfonyl)amino]acetamide N-[3-(3-methoxyphenyl)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)	5.37	10.52	-15.97	1	7	0	85	482.602	11	↓ MOL2 SDF SMILES Flexibase

22362360

Analogs

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Popular Name: N-[3-(4-methoxyphenyl)propyl]-2-[(2-methoxyphenyl)-(p-tolylsulfonyl)amino]acetamide N-[3-(4-methoxyphenyl)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)	5.39	10.52	-16.01	1	7	0	85	482.602	11	↓ MOL2 SDF SMILES Flexibase

22362366

Analogs

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Popular Name: N-[3-(3-isopropoxyphenyl)propyl]-2-[(2-methoxyphenyl)-(p-tolylsulfonyl)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)	6.11	12.04	-15.79	1	7	0	85	510.656	12	↓ MOL2 SDF SMILES Flexibase

22362368

Analogs

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Popular Name: N-[3-(4-isopropoxyphenyl)propyl]-2-[(2-methoxyphenyl)-(p-tolylsulfonyl)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)	6.13	12.05	-15.86	1	7	0	85	510.656	12	↓ MOL2 SDF SMILES Flexibase

22362418

Analogs

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Popular Name: N-[3-(4-ethoxyphenyl)propyl]-2-[(2-methoxyphenyl)-(p-tolylsulfonyl)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)	5.77	11.44	-15.93	1	7	0	85	496.629	12	↓ MOL2 SDF SMILES Flexibase

22362420

Analogs

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Popular Name: 2-[(2-methoxyphenyl)-(p-tolylsulfonyl)amino]-N-[3-(2-propoxyphenyl)propyl]acetamide 2-[(2-methoxyphenyl)-(p-tolylsul…

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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)	6.22	12.31	-15.05	1	7	0	85	510.656	13	↓ MOL2 SDF SMILES Flexibase

22362422

Analogs

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Popular Name: N-[3-(3,4-dimethoxyphenyl)propyl]-2-[(2-methoxyphenyl)-(p-tolylsulfonyl)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)	4.98	10.43	-18.64	1	8	0	94	512.628	12	↓ MOL2 SDF SMILES Flexibase

22362424

Analogs

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Popular Name: N-[(2R)-2-benzylbutyl]-2-[(2-methoxyphenyl)-(p-tolylsulfonyl)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)	6.07	12.22	-20.82	1	6	0	76	480.63	11	↓ MOL2 SDF SMILES Flexibase

22362426

Analogs

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Popular Name: N-[(2S)-2-benzylbutyl]-2-[(2-methoxyphenyl)-(p-tolylsulfonyl)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)	6.07	12.41	-14.12	1	6	0	76	480.63	11	↓ MOL2 SDF SMILES Flexibase

22362458

Analogs

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Popular Name: N-[(1S)-1,3-dimethyl-3-phenyl-butyl]-2-[(2-methoxyphenyl)-(p-tolylsulfonyl)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)	6.39	12.29	-20.15	1	6	0	76	494.657	10	↓ MOL2 SDF SMILES Flexibase

22362460

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R)-1,3-dimethyl-3-phenyl-butyl]-2-[(2-methoxyphenyl)-(p-tolylsulfonyl)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)	6.39	12.28	-19.87	1	6	0	76	494.657	10	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

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Structural Results Found: (before additional filtering)

SQL Query Was

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