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ZINC Item

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48451542

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-(2-bromo-4-fluoro-phenyl)-3-[2-oxo-2-(1-piperidyl)ethyl]urea 1-(2-bromo-4-fluoro-phenyl)-3-[2…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.61	5.3	-7.35	2	5	0	61	358.211	3	↓ MOL2 SDF SMILES Flexibase

65515444

Analogs

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Popular Name: 1-(4-fluorophenyl)-3-[2-oxo-2-(1-piperidyl)ethyl]urea 1-(4-fluorophenyl)-3-[2-oxo-2-(1…

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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)	1.87	4.52	-9.61	2	5	0	61	279.315	3	↓ MOL2 SDF SMILES Flexibase

69971064

Analogs

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Popular Name: 1-(4-bromophenyl)-3-[2-[(3S)-3-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(4-bromophenyl)-3-[2-[(3S)-3-m…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.75	5.71	-8.83	2	5	0	61	354.248	3	↓ MOL2 SDF SMILES Flexibase

41247669

Analogs

34951624
34951626

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Popular Name: 1-(3-chlorophenyl)-3-[(1S)-1-methyl-2-oxo-2-(1-piperidyl)ethyl]urea 1-(3-chlorophenyl)-3-[(1S)-1-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)	2.69	5.63	-10.03	2	5	0	61	309.797	3	↓ MOL2 SDF SMILES Flexibase

67486871

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-(4-bromophenyl)-3-[(1R)-1-methyl-2-[(2R)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(4-bromophenyl)-3-[(1R)-1-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)	3.17	6.29	-8.2	2	5	0	61	368.275	3	↓ MOL2 SDF SMILES Flexibase

67486872

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-(4-bromophenyl)-3-[(1R)-1-methyl-2-[(2S)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(4-bromophenyl)-3-[(1R)-1-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)	3.17	6.28	-7.96	2	5	0	61	368.275	3	↓ MOL2 SDF SMILES Flexibase

67486873

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-(4-bromophenyl)-3-[(1S)-1-methyl-2-[(2R)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(4-bromophenyl)-3-[(1S)-1-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)	3.17	6.27	-8.17	2	5	0	61	368.275	3	↓ MOL2 SDF SMILES Flexibase

67486874

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-(4-bromophenyl)-3-[(1S)-1-methyl-2-[(2S)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(4-bromophenyl)-3-[(1S)-1-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)	3.17	6.25	-8.47	2	5	0	61	368.275	3	↓ MOL2 SDF SMILES Flexibase

67486891

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-(3-bromophenyl)-3-[(1R)-1-methyl-2-[(2R)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(3-bromophenyl)-3-[(1R)-1-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)	3.15	6.29	-9.6	2	5	0	61	368.275	3	↓ MOL2 SDF SMILES Flexibase

67486892

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-(3-bromophenyl)-3-[(1R)-1-methyl-2-[(2S)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(3-bromophenyl)-3-[(1R)-1-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)	3.15	6.28	-9.29	2	5	0	61	368.275	3	↓ MOL2 SDF SMILES Flexibase

67486893

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-(3-bromophenyl)-3-[(1S)-1-methyl-2-[(2R)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(3-bromophenyl)-3-[(1S)-1-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)	3.15	6.27	-9.73	2	5	0	61	368.275	3	↓ MOL2 SDF SMILES Flexibase

67486894

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-(3-bromophenyl)-3-[(1S)-1-methyl-2-[(2S)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(3-bromophenyl)-3-[(1S)-1-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)	3.15	6.26	-10.05	2	5	0	61	368.275	3	↓ MOL2 SDF SMILES Flexibase

67486961

Analogs

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Popular Name: 1-(2,4-dimethylphenyl)-3-[(1R)-1-methyl-2-[(2R)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(2,4-dimethylphenyl)-3-[(1R)-1…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.19	7.25	-9.04	2	5	0	61	317.433	3	↓ MOL2 SDF SMILES Flexibase

67487019

Analogs

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Popular Name: 1-(4-methyl-3-nitro-phenyl)-3-[(1S)-1-methyl-2-oxo-2-(1-piperidyl)ethyl]urea 1-(4-methyl-3-nitro-phenyl)-3-[(…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.37	6.47	-10.49	2	8	0	107	334.376	4	↓ MOL2 SDF SMILES Flexibase

67487106

Analogs

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Popular Name: 1-(2-ethyl-6-methyl-phenyl)-3-[(1S)-1-methyl-2-[(2S)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(2-ethyl-6-methyl-phenyl)-3-[(…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.69	7.61	-8.29	2	5	0	61	331.46	4	↓ MOL2 SDF SMILES Flexibase

67487107

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-(2-ethyl-6-methyl-phenyl)-3-[(1R)-1-methyl-2-[(2S)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(2-ethyl-6-methyl-phenyl)-3-[(…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.69	7.61	-7.88	2	5	0	61	331.46	4	↓ MOL2 SDF SMILES Flexibase

67487108

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-(2-ethyl-6-methyl-phenyl)-3-[(1S)-1-methyl-2-[(2R)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(2-ethyl-6-methyl-phenyl)-3-[(…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.69	7.69	-8.35	2	5	0	61	331.46	4	↓ MOL2 SDF SMILES Flexibase

67487109

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-(2-ethyl-6-methyl-phenyl)-3-[(1R)-1-methyl-2-[(2R)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(2-ethyl-6-methyl-phenyl)-3-[(…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.69	7.62	-8.23	2	5	0	61	331.46	4	↓ MOL2 SDF SMILES Flexibase

67487158

Analogs

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Popular Name: 1-[(1R)-1-methyl-2-[(2R)-2-methyl-1-piperidyl]-2-oxo-ethyl]-3-[3-(trifluoromethyl)phenyl]urea 1-[(1R)-1-methyl-2-[(2R)-2-methy…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.24	6.68	-10.58	2	5	0	61	357.376	4	↓ MOL2 SDF SMILES Flexibase

67487159

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(1R)-1-methyl-2-[(2S)-2-methyl-1-piperidyl]-2-oxo-ethyl]-3-[3-(trifluoromethyl)phenyl]urea 1-[(1R)-1-methyl-2-[(2S)-2-methy…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.24	6.67	-10.32	2	5	0	61	357.376	4	↓ MOL2 SDF SMILES Flexibase

67487160

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(1S)-1-methyl-2-[(2R)-2-methyl-1-piperidyl]-2-oxo-ethyl]-3-[3-(trifluoromethyl)phenyl]urea 1-[(1S)-1-methyl-2-[(2R)-2-methy…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.24	6.65	-10.79	2	5	0	61	357.376	4	↓ MOL2 SDF SMILES Flexibase

67487161

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(1S)-1-methyl-2-[(2S)-2-methyl-1-piperidyl]-2-oxo-ethyl]-3-[3-(trifluoromethyl)phenyl]urea 1-[(1S)-1-methyl-2-[(2S)-2-methy…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.24	6.65	-11.12	2	5	0	61	357.376	4	↓ MOL2 SDF SMILES Flexibase

67487179

Analogs

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Popular Name: 1-(5-chloro-2-methoxy-phenyl)-3-[(1R)-1-methyl-2-[(2R)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(5-chloro-2-methoxy-phenyl)-3-…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.03	5.62	-9.49	2	6	0	71	353.85	4	↓ MOL2 SDF SMILES Flexibase

67487180

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-(5-chloro-2-methoxy-phenyl)-3-[(1R)-1-methyl-2-[(2S)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(5-chloro-2-methoxy-phenyl)-3-…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.03	5.61	-9.16	2	6	0	71	353.85	4	↓ MOL2 SDF SMILES Flexibase

67487181

Analogs

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Popular Name: 1-(5-chloro-2-methoxy-phenyl)-3-[(1S)-1-methyl-2-[(2R)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(5-chloro-2-methoxy-phenyl)-3-…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.03	5.57	-9.47	2	6	0	71	353.85	4	↓ MOL2 SDF SMILES Flexibase

67487182

Analogs

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Popular Name: 1-(5-chloro-2-methoxy-phenyl)-3-[(1S)-1-methyl-2-[(2S)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(5-chloro-2-methoxy-phenyl)-3-…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.03	5.56	-9.79	2	6	0	71	353.85	4	↓ MOL2 SDF SMILES Flexibase

67487218

Analogs

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Popular Name: 1-(2,6-diisopropylphenyl)-3-[(1R)-1-methyl-2-[(2R)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(2,6-diisopropylphenyl)-3-[(1R…

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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	9.53	-7.68	2	5	0	61	373.541	5	↓ MOL2 SDF SMILES Flexibase

67487219

Analogs

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Popular Name: 1-(2,6-diisopropylphenyl)-3-[(1R)-1-methyl-2-[(2S)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(2,6-diisopropylphenyl)-3-[(1R…

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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	9.52	-7.46	2	5	0	61	373.541	5	↓ MOL2 SDF SMILES Flexibase

67487220

Analogs

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Popular Name: 1-(2,6-diisopropylphenyl)-3-[(1S)-1-methyl-2-[(2R)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(2,6-diisopropylphenyl)-3-[(1S…

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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	9.95	-8.27	2	5	0	61	373.541	5	↓ MOL2 SDF SMILES Flexibase

67487221

Analogs

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Popular Name: 1-(2,6-diisopropylphenyl)-3-[(1S)-1-methyl-2-[(2S)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(2,6-diisopropylphenyl)-3-[(1S…

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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	9.68	-8.13	2	5	0	61	373.541	5	↓ MOL2 SDF SMILES Flexibase

67487286

Analogs

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Popular Name: 1-(2,4-dichlorophenyl)-3-[(1R)-1-methyl-2-[(2R)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(2,4-dichlorophenyl)-3-[(1R)-1…

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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)	3.65	6.89	-6.16	2	5	0	61	358.269	3	↓ MOL2 SDF SMILES Flexibase

67487287

Analogs

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Popular Name: 1-(2,4-dichlorophenyl)-3-[(1R)-1-methyl-2-[(2S)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(2,4-dichlorophenyl)-3-[(1R)-1…

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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)	3.65	6.85	-5.94	2	5	0	61	358.269	3	↓ MOL2 SDF SMILES Flexibase

67487288

Analogs

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Popular Name: 1-(2,4-dichlorophenyl)-3-[(1S)-1-methyl-2-[(2R)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(2,4-dichlorophenyl)-3-[(1S)-1…

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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)	3.65	6.79	-6.43	2	5	0	61	358.269	3	↓ MOL2 SDF SMILES Flexibase

67487289

Analogs

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Popular Name: 1-(2,4-dichlorophenyl)-3-[(1S)-1-methyl-2-[(2S)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(2,4-dichlorophenyl)-3-[(1S)-1…

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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)	3.65	6.77	-6.62	2	5	0	61	358.269	3	↓ MOL2 SDF SMILES Flexibase

67487359

Analogs

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Popular Name: 1-(4-isopropylphenyl)-3-[(1R)-1-methyl-2-[(2R)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(4-isopropylphenyl)-3-[(1R)-1-…

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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)	3.88	7.58	-8.58	2	5	0	61	331.46	4	↓ MOL2 SDF SMILES Flexibase

67487360

Analogs

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Popular Name: 1-(4-isopropylphenyl)-3-[(1R)-1-methyl-2-[(2S)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(4-isopropylphenyl)-3-[(1R)-1-…

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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)	3.88	7.58	-8.35	2	5	0	61	331.46	4	↓ MOL2 SDF SMILES Flexibase

67487361

Analogs

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Popular Name: 1-(4-isopropylphenyl)-3-[(1S)-1-methyl-2-[(2R)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(4-isopropylphenyl)-3-[(1S)-1-…

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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)	3.88	7.56	-8.54	2	5	0	61	331.46	4	↓ MOL2 SDF SMILES Flexibase

67487362

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-(4-isopropylphenyl)-3-[(1S)-1-methyl-2-[(2S)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(4-isopropylphenyl)-3-[(1S)-1-…

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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)	3.88	7.56	-8.89	2	5	0	61	331.46	4	↓ MOL2 SDF SMILES Flexibase

67487379

Analogs

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Popular Name: 1-[(1S)-1-methyl-2-oxo-2-(1-piperidyl)ethyl]-3-[4-(trifluoromethoxy)phenyl]urea 1-[(1S)-1-methyl-2-oxo-2-(1-pipe…

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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	4.89	-9.42	2	6	0	71	359.348	5	↓ MOL2 SDF SMILES Flexibase

67487545

Analogs

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Popular Name: 1-(2,3-dichlorophenyl)-3-[(1R)-1-methyl-2-[(2R)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(2,3-dichlorophenyl)-3-[(1R)-1…

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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)	3.62	6.85	-7.16	2	5	0	61	358.269	3	↓ MOL2 SDF SMILES Flexibase

67487546

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-(2,3-dichlorophenyl)-3-[(1R)-1-methyl-2-[(2S)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(2,3-dichlorophenyl)-3-[(1R)-1…

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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)	3.62	6.8	-6.95	2	5	0	61	358.269	3	↓ MOL2 SDF SMILES Flexibase

67487547

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-(2,3-dichlorophenyl)-3-[(1S)-1-methyl-2-[(2R)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(2,3-dichlorophenyl)-3-[(1S)-1…

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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)	3.62	6.74	-7.38	2	5	0	61	358.269	3	↓ MOL2 SDF SMILES Flexibase

67487548

Analogs

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Popular Name: 1-(2,3-dichlorophenyl)-3-[(1S)-1-methyl-2-[(2S)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(2,3-dichlorophenyl)-3-[(1S)-1…

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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)	3.62	6.74	-7.53	2	5	0	61	358.269	3	↓ MOL2 SDF SMILES Flexibase

67487942

Analogs

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Popular Name: 1-(3-cyanophenyl)-3-[(1S)-1-methyl-2-oxo-2-(1-piperidyl)ethyl]urea 1-(3-cyanophenyl)-3-[(1S)-1-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)	1.76	5.5	-13.01	2	6	0	85	300.362	3	↓ MOL2 SDF SMILES Flexibase

67487974

Analogs

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Popular Name: 1-(3-chloro-4-methoxy-phenyl)-3-[(1R)-1-methyl-2-[(2R)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(3-chloro-4-methoxy-phenyl)-3-…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.03	5.52	-11.48	2	6	0	71	353.85	4	↓ MOL2 SDF SMILES Flexibase

67487975

Analogs

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Popular Name: 1-(3-chloro-4-methoxy-phenyl)-3-[(1R)-1-methyl-2-[(2S)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(3-chloro-4-methoxy-phenyl)-3-…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.03	5.5	-11.21	2	6	0	71	353.85	4	↓ MOL2 SDF SMILES Flexibase

67487976

Analogs

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Popular Name: 1-(3-chloro-4-methoxy-phenyl)-3-[(1S)-1-methyl-2-[(2R)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(3-chloro-4-methoxy-phenyl)-3-…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.03	5.49	-11.61	2	6	0	71	353.85	4	↓ MOL2 SDF SMILES Flexibase

67487977

Analogs

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Popular Name: 1-(3-chloro-4-methoxy-phenyl)-3-[(1S)-1-methyl-2-[(2S)-2-methyl-1-piperidyl]-2-oxo-ethyl]urea 1-(3-chloro-4-methoxy-phenyl)-3-…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.03	5.49	-11.97	2	6	0	71	353.85	4	↓ MOL2 SDF SMILES Flexibase

67537505

Analogs

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Popular Name: 1-[(1S)-1-methyl-2-[(2S)-2-methyl-1-piperidyl]-2-oxo-ethyl]-3-(2-propoxyphenyl)urea 1-[(1S)-1-methyl-2-[(2S)-2-methy…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.25	6.85	-8.77	2	6	0	71	347.459	6	↓ MOL2 SDF SMILES Flexibase

67537506

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(1R)-1-methyl-2-[(2S)-2-methyl-1-piperidyl]-2-oxo-ethyl]-3-(2-propoxyphenyl)urea 1-[(1R)-1-methyl-2-[(2S)-2-methy…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.25	6.81	-8.65	2	6	0	71	347.459	6	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

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Structural Results Found: (before additional filtering)

SQL Query Was

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