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ZINC Item

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24989470

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-(4-methoxyphenyl)ethyl]-2-[[(2R)-2-(4-methylphenoxy)propanoyl]amino]benzamide N-[2-(4-methoxyphenyl)ethyl]-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)	4.62	10.96	-18.8	2	6	0	77	432.52	9	↓ MOL2 SDF SMILES Flexibase

24989474

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-(4-methoxyphenyl)ethyl]-2-[[(2S)-2-(4-methylphenoxy)propanoyl]amino]benzamide N-[2-(4-methoxyphenyl)ethyl]-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)	4.62	10.93	-18.58	2	6	0	77	432.52	9	↓ MOL2 SDF SMILES Flexibase

13683597

Analogs

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Popular Name: benzamide, 2-[[(4-bromophenoxy)acetyl]amino]-N-(2-phenylethyl)- benzamide, 2-[[(4-bromophenoxy)a…

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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)	4.56	10.98	-13.98	2	5	0	67	453.336	8	↓ MOL2 SDF SMILES Flexibase

13683613

Analogs

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Popular Name: 2-[[2-(4-bromophenoxy)acetyl]amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide 2-[[2-(4-bromophenoxy)acetyl]ami…

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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)	4.20	10.18	-18.69	2	7	0	86	513.388	10	↓ MOL2 SDF SMILES Flexibase

13683638

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: benzamide, 2-[[(4-bromo-3-methylphenoxy)acetyl]amino]-N-(2-phenylethyl)- benzamide, 2-[[(4-bromo-3-methyl…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.93	11.48	-13.98	2	5	0	67	467.363	8	↓ MOL2 SDF SMILES Flexibase

13683693

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[2-(4-bromo-3,5-dimethyl-phenoxy)acetyl]amino]-N-phenethyl-benzamide 2-[[2-(4-bromo-3,5-dimethyl-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)	5.31	12.11	-14.34	2	5	0	67	481.39	8	↓ MOL2 SDF SMILES Flexibase

13683759

Analogs

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Popular Name: 2-[[2-(2-chlorophenoxy)acetyl]amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide 2-[[2-(2-chlorophenoxy)acetyl]am…

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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)	4.02	10.09	-21.21	2	7	0	86	468.937	10	↓ MOL2 SDF SMILES Flexibase

13683784

Analogs

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Popular Name: benzamide, 2-[[(2-bromo-4-chlorophenoxy)acetyl]amino]-N-(2-phenylethyl)- benzamide, 2-[[(2-bromo-4-chloro…

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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)	5.16	11.44	-14.95	2	5	0	67	487.781	8	↓ MOL2 SDF SMILES Flexibase

13683833

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: benzamide, 2-[[(2-bromo-4-ethylphenoxy)acetyl]amino]-N-(2-phenylethyl)- benzamide, 2-[[(2-bromo-4-ethylp…

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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	12.44	-15.91	2	5	0	67	481.39	9	↓ MOL2 SDF SMILES Flexibase

13683889

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[2-(2-bromo-4-isopropyl-phenoxy)acetyl]amino]-N-phenethyl-benzamide 2-[[2-(2-bromo-4-isopropyl-pheno…

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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)	6.00	12.86	-15.48	2	5	0	67	495.417	9	↓ MOL2 SDF SMILES Flexibase

13683967

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: benzamide, 2-[[[2-bromo-4-(1,1-dimethylethyl)phenoxy]acetyl]amino]-N-(2-phenylethyl)- benzamide, 2-[[[2-bromo-4-(1,1-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)	6.19	13.33	-15.57	2	5	0	67	509.444	9	↓ MOL2 SDF SMILES Flexibase

13684023

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[2-(3,5-dimethoxyphenoxy)acetyl]amino]-N-phenethyl-benzamide 2-[[2-(3,5-dimethoxyphenoxy)acet…

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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	8.95	-17.27	2	7	0	86	434.492	10	↓ MOL2 SDF SMILES Flexibase

13684065

Analogs

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Popular Name: 2-[[2-(3,5-dimethoxyphenoxy)acetyl]amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide 2-[[2-(3,5-dimethoxyphenoxy)acet…

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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)	3.44	8.15	-21.85	2	9	0	104	494.544	12	↓ MOL2 SDF SMILES Flexibase

13684220

Analogs

6342298

Draw Identity 99% 90% 80% 70%

Popular Name: benzamide, 2-[[(4-chloro-3,5-dimethylphenoxy)acetyl]amino]-N-(2-phenylethyl)- benzamide, 2-[[(4-chloro-3,5-dim…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.18	12.03	-14.36	2	5	0	67	436.939	8	↓ MOL2 SDF SMILES Flexibase

13684245

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[2-(4-chloro-3,5-dimethyl-phenoxy)acetyl]amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide 2-[[2-(4-chloro-3,5-dimethyl-phe…

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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)	4.83	11.23	-18.99	2	7	0	86	496.991	10	↓ MOL2 SDF SMILES Flexibase

13684269

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: benzamide, 2-[[[4-(1,1-dimethylethyl)phenoxy]acetyl]amino]-N-(2-phenylethyl)- benzamide, 2-[[[4-(1,1-dimethyle…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.45	12.68	-14.48	2	5	0	67	430.548	9	↓ MOL2 SDF SMILES Flexibase

13684279

Analogs

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Popular Name: 2-[[2-(4-tert-butylphenoxy)acetyl]amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide 2-[[2-(4-tert-butylphenoxy)acety…

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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)	5.10	11.88	-19.1	2	7	0	86	490.6	11	↓ MOL2 SDF SMILES Flexibase

13684308

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[[2-(4-chloro-3-methyl-phenoxy)acetyl]amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide 2-[[2-(4-chloro-3-methyl-phenoxy…

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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)	4.45	10.58	-18.57	2	7	0	86	482.964	10	↓ MOL2 SDF SMILES Flexibase

13684330

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: benzamide, 2-[[(4-bromo-2-chlorophenoxy)acetyl]amino]-N-(2-phenylethyl)- benzamide, 2-[[(4-bromo-2-chloro…

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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)	5.16	11.44	-15.08	2	5	0	67	487.781	8	↓ MOL2 SDF SMILES Flexibase

13684385

Analogs

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Popular Name: benzamide, 2-[[(2,5-dimethylphenoxy)acetyl]amino]-N-(2-phenylethyl)- benzamide, 2-[[(2,5-dimethylphen…

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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)	4.57	11.74	-14.84	2	5	0	67	402.494	8	↓ MOL2 SDF SMILES Flexibase

13684405

Analogs

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Popular Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[[2-(2,5-dimethylphenoxy)acetyl]amino]benzamide N-[2-(3,4-dimethoxyphenyl)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)	4.22	10.93	-19.53	2	7	0	86	462.546	10	↓ MOL2 SDF SMILES Flexibase

13684437

Analogs

1962560

Draw Identity 99% 90% 80% 70%

Popular Name: benzamide, 2-[[(4-ethylphenoxy)acetyl]amino]-N-(2-phenylethyl)- benzamide, 2-[[(4-ethylphenoxy)a…

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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	11.8	-14.75	2	5	0	67	402.494	9	↓ MOL2 SDF SMILES Flexibase

13684458

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[[2-(4-ethylphenoxy)acetyl]amino]benzamide N-[2-(3,4-dimethoxyphenyl)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)	4.31	10.99	-19.4	2	7	0	86	462.546	11	↓ MOL2 SDF SMILES Flexibase

13684477

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: benzamide, 2-[[[4-(1-methylethyl)phenoxy]acetyl]amino]-N-(2-phenylethyl)- benzamide, 2-[[[4-(1-methylethyl…

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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	12.28	-14.65	2	5	0	67	416.521	9	↓ MOL2 SDF SMILES Flexibase

13684501

Analogs

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Popular Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[[2-(4-isopropylphenoxy)acetyl]amino]benzamide N-[2-(3,4-dimethoxyphenyl)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)	4.91	11.48	-19.25	2	7	0	86	476.573	11	↓ MOL2 SDF SMILES Flexibase

13684538

Analogs

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Popular Name: N-phenethyl-2-[[2-(2,3,5-trimethylphenoxy)acetyl]amino]benzamide N-phenethyl-2-[[2-(2,3,5-trimeth…

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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)	4.95	12.28	-15.02	2	5	0	67	416.521	8	↓ MOL2 SDF SMILES Flexibase

13684580

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[[2-(2,3,5-trimethylphenoxy)acetyl]amino]benzamide N-[2-(3,4-dimethoxyphenyl)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)	4.60	11.48	-19.59	2	7	0	86	476.573	10	↓ MOL2 SDF SMILES Flexibase

14006290

Analogs

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Popular Name: benzamide, 2-[[2-(4-methoxyphenoxy)-1-oxopropyl]methylamino]-N-(2-phenylethyl)- benzamide, 2-[[2-(4-methoxypheno…

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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	12.1	-19.21	1	6	0	68	432.52	9	↓ MOL2 SDF SMILES Flexibase

14006291

Analogs

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Popular Name: benzamide, 2-[[2-(4-methoxyphenoxy)-1-oxopropyl]methylamino]-N-(2-phenylethyl)- benzamide, 2-[[2-(4-methoxypheno…

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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	11.92	-22.32	1	6	0	68	432.52	9	↓ MOL2 SDF SMILES Flexibase

14006566

Analogs

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Popular Name: benzamide, 2-[[2-(2-methoxyphenoxy)-1-oxopropyl]amino]-N-(2-phenylethyl)- benzamide, 2-[[2-(2-methoxypheno…

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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)	3.72	10.71	-18.1	2	6	0	77	418.493	9	↓ MOL2 SDF SMILES Flexibase

14006567

Analogs

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Popular Name: benzamide, 2-[[2-(2-methoxyphenoxy)-1-oxopropyl]amino]-N-(2-phenylethyl)- benzamide, 2-[[2-(2-methoxypheno…

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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)	3.72	10.67	-18.12	2	6	0	77	418.493	9	↓ MOL2 SDF SMILES Flexibase

14007033

Analogs

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Popular Name: benzamide, 2-[[2-(4-chlorophenoxy)-1-oxopropyl]amino]-N-(2-phenylethyl)- benzamide, 2-[[2-(4-chlorophenox…

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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	11.46	-13.78	2	5	0	67	422.912	8	↓ MOL2 SDF SMILES Flexibase

14007035

Analogs

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Popular Name: benzamide, 2-[[2-(4-chlorophenoxy)-1-oxopropyl]amino]-N-(2-phenylethyl)- benzamide, 2-[[2-(4-chlorophenox…

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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	11.51	-13.9	2	5	0	67	422.912	8	↓ MOL2 SDF SMILES Flexibase

14008284

Analogs

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Popular Name: 2-[[(2S)-2-(2,5-dimethylphenoxy)propanoyl]-methyl-amino]-N-phenethyl-benzamide 2-[[(2S)-2-(2,5-dimethylphenoxy)…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.18	14.21	-18.64	1	5	0	59	430.548	8	↓ MOL2 SDF SMILES Flexibase

14008287

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Popular Name: 2-[[(2R)-2-(2,5-dimethylphenoxy)propanoyl]-methyl-amino]-N-phenethyl-benzamide 2-[[(2R)-2-(2,5-dimethylphenoxy)…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.18	14.24	-19.5	1	5	0	59	430.548	8	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

ring.id = 146620
filter.purchasability = annotated
page.format = targets
page.num = 1

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SQL Query Was

SELECT DISTINCT(ci.sub_id_fk) AS sub_id FROM catalog_item AS ci INNER JOIN catalog AS c ON ci.cat_id_fk=c.cat_id INNER JOIN hasring AS hr ON ci.sub_id_fk=hr.sub_id_fk INNER JOIN rings AS r ON hr.rings_fk=r.rings_id  WHERE r.rings_id = 146620 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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