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ZINC Item

Suppliers, Protomers, & Similar Substances

22702642

Analogs

4201609

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4-formylphenoxy)-N-[4-(3-methylphenoxy)phenyl]acetamide 2-(4-formylphenoxy)-N-[4-(3-meth…

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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)	4.77	10.22	-23.58	1	5	0	65	361.397	7	↓ MOL2 SDF SMILES Flexibase

13014205

Analogs

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Popular Name: 3-[2-[2-oxo-2-[(4-phenoxyphenyl)amino]ethoxy]phenyl]propanoic 3-[2-[2-oxo-2-[(4-phenoxyphenyl)…

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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	11.11	-68.35	1	6	-1	88	390.415	9	↓ MOL2 SDF SMILES Flexibase

13014719

Analogs

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Popular Name: 2,3,5-trichloro-6-[2-oxo-2-[(4-phenoxyphenyl)amino]ethoxy]benzoic 2,3,5-trichloro-6-[2-oxo-2-[(4-p…

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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)	5.94	11.11	-56.74	1	6	-1	88	465.696	7	↓ MOL2 SDF SMILES Flexibase

22743577

Analogs

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Popular Name: 3-methoxy-2-[2-oxo-2-[(4-phenoxyphenyl)amino]ethoxy]benzamide 3-methoxy-2-[2-oxo-2-[(4-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)	3.68	7.32	-27.29	3	7	0	100	392.411	8	↓ MOL2 SDF SMILES Flexibase

13409775

Analogs

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Popular Name: 2-[(1R)-1-methyl-2-oxo-2-[(4-phenoxyphenyl)amino]ethoxy]benzoic 2-[(1R)-1-methyl-2-oxo-2-[(4-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)	4.86	10.57	-76.14	1	6	-1	88	376.388	7	↓ MOL2 SDF SMILES Flexibase

13409778

Analogs

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Popular Name: 2-[(1S)-1-methyl-2-oxo-2-[(4-phenoxyphenyl)amino]ethoxy]benzoic 2-[(1S)-1-methyl-2-oxo-2-[(4-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)	4.86	10.6	-77.12	1	6	-1	88	376.388	7	↓ MOL2 SDF SMILES Flexibase

13410868

Analogs

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Popular Name: 2-[2-[[4-(4-methylphenoxy)phenyl]amino]-2-oxo-ethoxy]benzoic 2-[2-[[4-(4-methylphenoxy)phenyl…

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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	10.62	-76.2	1	6	-1	88	376.388	7	↓ MOL2 SDF SMILES Flexibase

13410872

Analogs

13080213

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Popular Name: 2-[2-[[4-(4-ethoxyphenoxy)phenyl]amino]-2-oxo-ethoxy]benzoic 2-[2-[[4-(4-ethoxyphenoxy)phenyl…

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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	10.15	-76.17	1	7	-1	97	406.414	9	↓ MOL2 SDF SMILES Flexibase

13410876

Analogs

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Popular Name: 2-[2-[[4-(4-bromophenoxy)phenyl]amino]-2-oxo-ethoxy]benzoic 2-[2-[[4-(4-bromophenoxy)phenyl]…

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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	10.58	-74.82	1	6	-1	88	441.257	7	↓ MOL2 SDF SMILES Flexibase

13412050

Analogs

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Popular Name: 2-[2-[[4-(2-chlorophenoxy)phenyl]amino]-2-oxo-ethoxy]benzoic 2-[2-[[4-(2-chlorophenoxy)phenyl…

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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)	5.13	10.5	-76.68	1	6	-1	88	396.806	7	↓ MOL2 SDF SMILES Flexibase

13412459

Analogs

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Popular Name: 4-[(1R)-1-methyl-2-oxo-2-[(4-phenoxyphenyl)amino]ethoxy]benzoic 4-[(1R)-1-methyl-2-oxo-2-[(4-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	10.14	-57.7	1	6	-1	88	376.388	7	↓ MOL2 SDF SMILES Flexibase

13412461

Analogs

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Popular Name: 4-[(1S)-1-methyl-2-oxo-2-[(4-phenoxyphenyl)amino]ethoxy]benzoic 4-[(1S)-1-methyl-2-oxo-2-[(4-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	10.13	-59.1	1	6	-1	88	376.388	7	↓ MOL2 SDF SMILES Flexibase

13413093

Analogs

13079834

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Popular Name: 4-[2-[[4-(4-methylphenoxy)phenyl]amino]-2-oxo-ethoxy]benzoic 4-[2-[[4-(4-methylphenoxy)phenyl…

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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	10.15	-58.54	1	6	-1	88	376.388	7	↓ MOL2 SDF SMILES Flexibase

13413096

Analogs

13079834

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Popular Name: 4-[2-[[4-(4-ethoxyphenoxy)phenyl]amino]-2-oxo-ethoxy]benzoic 4-[2-[[4-(4-ethoxyphenoxy)phenyl…

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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	9.67	-58.68	1	7	-1	97	406.414	9	↓ MOL2 SDF SMILES Flexibase

13413099

Analogs

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Popular Name: 4-[2-[[4-(4-bromophenoxy)phenyl]amino]-2-oxo-ethoxy]benzoic 4-[2-[[4-(4-bromophenoxy)phenyl]…

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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)	5.27	10.09	-57.75	1	6	-1	88	441.257	7	↓ MOL2 SDF SMILES Flexibase

13414283

Analogs

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Popular Name: 4-[2-[[4-(2-chlorophenoxy)phenyl]amino]-2-oxo-ethoxy]benzoic 4-[2-[[4-(2-chlorophenoxy)phenyl…

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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)	5.09	10.01	-59.03	1	6	-1	88	396.806	7	↓ MOL2 SDF SMILES Flexibase

13418823

Analogs

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Popular Name: 3-[(1R)-1-methyl-2-oxo-2-[(4-phenoxyphenyl)amino]ethoxy]benzoic 3-[(1R)-1-methyl-2-oxo-2-[(4-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)	4.80	10.06	-66.51	1	6	-1	88	376.388	7	↓ MOL2 SDF SMILES Flexibase

13418824

Analogs

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Popular Name: 3-[(1S)-1-methyl-2-oxo-2-[(4-phenoxyphenyl)amino]ethoxy]benzoic 3-[(1S)-1-methyl-2-oxo-2-[(4-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)	4.80	10.16	-66.35	1	6	-1	88	376.388	7	↓ MOL2 SDF SMILES Flexibase

13419079

Analogs

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Popular Name: 3-[2-[[4-(4-methylphenoxy)phenyl]amino]-2-oxo-ethoxy]benzoic 3-[2-[[4-(4-methylphenoxy)phenyl…

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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	10.13	-66.4	1	6	-1	88	376.388	7	↓ MOL2 SDF SMILES Flexibase

13419080

Analogs

13080027

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[2-[[4-(4-ethoxyphenoxy)phenyl]amino]-2-oxo-ethoxy]benzoic 3-[2-[[4-(4-ethoxyphenoxy)phenyl…

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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)	4.87	9.65	-66.57	1	7	-1	97	406.414	9	↓ MOL2 SDF SMILES Flexibase

13419081

Analogs

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Popular Name: 3-[2-[[4-(4-bromophenoxy)phenyl]amino]-2-oxo-ethoxy]benzoic 3-[2-[[4-(4-bromophenoxy)phenyl]…

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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)	5.25	10.08	-65.63	1	6	-1	88	441.257	7	↓ MOL2 SDF SMILES Flexibase

13419447

Analogs

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Popular Name: 3-[2-[[4-(2-chlorophenoxy)phenyl]amino]-2-oxo-ethoxy]benzoic 3-[2-[[4-(2-chlorophenoxy)phenyl…

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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)	5.07	9.99	-66.83	1	6	-1	88	396.806	7	↓ MOL2 SDF SMILES Flexibase

13419625

Analogs

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Popular Name: 3-methoxy-4-[2-oxo-2-[(4-phenoxyphenyl)amino]ethoxy]benzoic 3-methoxy-4-[2-oxo-2-[(4-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)	4.05	9.24	-60.04	1	7	-1	97	392.387	8	↓ MOL2 SDF SMILES Flexibase

13419710

Analogs

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Popular Name: 3-methoxy-4-[(1S)-1-methyl-2-oxo-2-[(4-phenoxyphenyl)amino]ethoxy]benzoic 3-methoxy-4-[(1S)-1-methyl-2-oxo…

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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	9.84	-59.53	1	7	-1	97	406.414	8	↓ MOL2 SDF SMILES Flexibase

13419711

Analogs

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Popular Name: 3-methoxy-4-[(1R)-1-methyl-2-oxo-2-[(4-phenoxyphenyl)amino]ethoxy]benzoic 3-methoxy-4-[(1R)-1-methyl-2-oxo…

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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	9.79	-59.22	1	7	-1	97	406.414	8	↓ MOL2 SDF SMILES Flexibase

13420092

Analogs

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Popular Name: 3-methoxy-4-[2-[[4-(4-methylphenoxy)phenyl]amino]-2-oxo-ethoxy]benzoic 3-methoxy-4-[2-[[4-(4-methylphen…

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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)	4.50	9.91	-59.53	1	7	-1	97	406.414	8	↓ MOL2 SDF SMILES Flexibase

13420093

Analogs

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Popular Name: 4-[2-[[4-(4-ethoxyphenoxy)phenyl]amino]-2-oxo-ethoxy]-3-methoxy-benzoic 4-[2-[[4-(4-ethoxyphenoxy)phenyl…

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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)	4.49	9.43	-60.29	1	8	-1	106	436.44	10	↓ MOL2 SDF SMILES Flexibase

13420094

Analogs

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Popular Name: 4-[2-[[4-(4-bromophenoxy)phenyl]amino]-2-oxo-ethoxy]-3-methoxy-benzoic 4-[2-[[4-(4-bromophenoxy)phenyl]…

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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)	4.86	9.86	-58.85	1	7	-1	97	471.283	8	↓ MOL2 SDF SMILES Flexibase

13420596

Analogs

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Popular Name: 4-[2-[[4-(2-chlorophenoxy)phenyl]amino]-2-oxo-ethoxy]-3-methoxy-benzoic 4-[2-[[4-(2-chlorophenoxy)phenyl…

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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	9.76	-60.52	1	7	-1	97	426.832	8	↓ MOL2 SDF SMILES Flexibase

13420798

Analogs

12819985

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Popular Name: 2-[4-[2-oxo-2-[(4-phenoxyphenyl)amino]ethoxy]phenyl]acetic 2-[4-[2-oxo-2-[(4-phenoxyphenyl)…

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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	10.28	-56.43	1	6	-1	88	376.388	8	↓ MOL2 SDF SMILES Flexibase

13420878

Analogs

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Popular Name: 2-[4-[(1R)-1-methyl-2-oxo-2-[(4-phenoxyphenyl)amino]ethoxy]phenyl]acetic 2-[4-[(1R)-1-methyl-2-oxo-2-[(4-…

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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)	4.34	10.93	-56.35	1	6	-1	88	390.415	8	↓ MOL2 SDF SMILES Flexibase

13420879

Analogs

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Popular Name: 2-[4-[(1S)-1-methyl-2-oxo-2-[(4-phenoxyphenyl)amino]ethoxy]phenyl]acetic 2-[4-[(1S)-1-methyl-2-oxo-2-[(4-…

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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)	4.34	10.92	-57.34	1	6	-1	88	390.415	8	↓ MOL2 SDF SMILES Flexibase

13421214

Analogs

12819985

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Popular Name: 2-[4-[2-[[4-(4-ethoxyphenoxy)phenyl]amino]-2-oxo-ethoxy]phenyl]acetic 2-[4-[2-[[4-(4-ethoxyphenoxy)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)	4.41	10.47	-57.13	1	7	-1	97	420.441	10	↓ MOL2 SDF SMILES Flexibase

13421215

Analogs

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Popular Name: 2-[4-[2-[[4-(4-bromophenoxy)phenyl]amino]-2-oxo-ethoxy]phenyl]acetic 2-[4-[2-[[4-(4-bromophenoxy)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)	4.79	10.91	-55.66	1	6	-1	88	455.284	8	↓ MOL2 SDF SMILES Flexibase

13421669

Analogs

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Popular Name: 2-[4-[2-[[4-(2-chlorophenoxy)phenyl]amino]-2-oxo-ethoxy]phenyl]acetic 2-[4-[2-[[4-(2-chlorophenoxy)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)	4.61	10.8	-56.67	1	6	-1	88	410.833	8	↓ MOL2 SDF SMILES Flexibase

13421873

Analogs

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Popular Name: 4-[2-oxo-2-[(4-phenoxyphenyl)amino]ethoxy]benzene-1,3-dicarboxylic 4-[2-oxo-2-[(4-phenoxyphenyl)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)	4.38	9.61	-132.94	1	8	-2	128	405.362	8	↓ MOL2 SDF SMILES Flexibase

13421959

Analogs

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Popular Name: 4-[(1R)-1-methyl-2-oxo-2-[(4-phenoxyphenyl)amino]ethoxy]benzene-1,3-dicarboxylic 4-[(1R)-1-methyl-2-oxo-2-[(4-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)	4.75	10.2	-133.01	1	8	-2	128	419.389	8	↓ MOL2 SDF SMILES Flexibase

13421960

Analogs

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Popular Name: 4-[(1S)-1-methyl-2-oxo-2-[(4-phenoxyphenyl)amino]ethoxy]benzene-1,3-dicarboxylic 4-[(1S)-1-methyl-2-oxo-2-[(4-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)	4.75	10.19	-133.88	1	8	-2	128	419.389	8	↓ MOL2 SDF SMILES Flexibase

13422359

Analogs

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Popular Name: 4-[2-[[4-(4-methylphenoxy)phenyl]amino]-2-oxo-ethoxy]benzene-1,3-dicarboxylic 4-[2-[[4-(4-methylphenoxy)phenyl…

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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	10.26	-133.04	1	8	-2	128	419.389	8	↓ MOL2 SDF SMILES Flexibase

13422360

Analogs

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Popular Name: 4-[2-[[4-(4-ethoxyphenoxy)phenyl]amino]-2-oxo-ethoxy]benzene-1,3-dicarboxylic 4-[2-[[4-(4-ethoxyphenoxy)phenyl…

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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)	4.82	9.78	-133.5	1	9	-2	137	449.415	10	↓ MOL2 SDF SMILES Flexibase

13422361

Analogs

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Popular Name: 4-[2-[[4-(4-bromophenoxy)phenyl]amino]-2-oxo-ethoxy]benzene-1,3-dicarboxylic 4-[2-[[4-(4-bromophenoxy)phenyl]…

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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)	5.19	10.23	-131.96	1	8	-2	128	484.258	8	↓ MOL2 SDF SMILES Flexibase

13422864

Analogs

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Popular Name: 4-[2-[[4-(2-chlorophenoxy)phenyl]amino]-2-oxo-ethoxy]benzene-1,3-dicarboxylic 4-[2-[[4-(2-chlorophenoxy)phenyl…

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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)	5.01	10.12	-132.77	1	8	-2	128	439.807	8	↓ MOL2 SDF SMILES Flexibase

13423055

Analogs

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Popular Name: 3,5-dichloro-4-[2-oxo-2-[(4-phenoxyphenyl)amino]ethoxy]benzoic 3,5-dichloro-4-[2-oxo-2-[(4-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)	5.67	10.66	-48.93	1	6	-1	88	431.251	7	↓ MOL2 SDF SMILES Flexibase

14013267

Analogs

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Popular Name: butanamide, 2-(4-methylphenoxy)-N-(4-phenoxyphenyl)- butanamide, 2-(4-methylphenoxy)-…

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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)	5.87	11.69	-13.65	1	4	0	48	361.441	7	↓ MOL2 SDF SMILES Flexibase

14013269

Analogs

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Popular Name: butanamide, 2-(4-methylphenoxy)-N-(4-phenoxyphenyl)- butanamide, 2-(4-methylphenoxy)-…

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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)	5.87	11.69	-14.09	1	4	0	48	361.441	7	↓ MOL2 SDF SMILES Flexibase

55428010

Analogs

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Popular Name: N-[4-(2-cyanophenoxy)phenyl]-2-(2-nitrophenoxy)acetamide N-[4-(2-cyanophenoxy)phenyl]-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)	4.17	11.42	-30.03	1	8	0	117	389.367	7	↓ MOL2 SDF SMILES Flexibase

55428200

Analogs

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Popular Name: N-[4-(2-cyanophenoxy)phenyl]-2-(2-methoxyphenoxy)acetamide N-[4-(2-cyanophenoxy)phenyl]-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)	3.87	9.98	-21.73	1	6	0	81	374.396	7	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

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Structural Results Found: (before additional filtering)

SQL Query Was

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