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ZINC Item

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69466571

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-(4-methoxyphenyl)-1-(2-methylpyrazol-3-yl)ethanol (1R)-1-(4-methoxyphenyl)-1-(2-me…

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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)	1.43	3.19	-7.67	1	4	0	47	232.283	3	↓ MOL2 SDF SMILES Flexibase

69466572

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-1-(4-methoxyphenyl)-1-(2-methylpyrazol-3-yl)ethanol (1S)-1-(4-methoxyphenyl)-1-(2-me…

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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)	1.43	3.1	-7.66	1	4	0	47	232.283	3	↓ MOL2 SDF SMILES Flexibase

69466575

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-(3-methoxyphenyl)-1-(2-methylpyrazol-3-yl)ethanol (1R)-1-(3-methoxyphenyl)-1-(2-me…

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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)	1.40	3.19	-7.12	1	4	0	47	232.283	3	↓ MOL2 SDF SMILES Flexibase

69466576

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-1-(3-methoxyphenyl)-1-(2-methylpyrazol-3-yl)ethanol (1S)-1-(3-methoxyphenyl)-1-(2-me…

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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)	1.40	3.11	-7.26	1	4	0	47	232.283	3	↓ MOL2 SDF SMILES Flexibase

69466577

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-(2-methoxyphenyl)-1-(2-methylpyrazol-3-yl)ethanol (1R)-1-(2-methoxyphenyl)-1-(2-me…

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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)	1.38	3.44	-7.32	1	4	0	47	232.283	3	↓ MOL2 SDF SMILES Flexibase

69466579

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-1-(2-methoxyphenyl)-1-(2-methylpyrazol-3-yl)ethanol (1S)-1-(2-methoxyphenyl)-1-(2-me…

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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)	1.38	3.26	-6.57	1	4	0	47	232.283	3	↓ MOL2 SDF SMILES Flexibase

69466584

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-(2-methylpyrazol-3-yl)-1-phenyl-butan-1-ol (1R)-1-(2-methylpyrazol-3-yl)-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)	2.43	5.58	-6.11	1	3	0	38	230.311	4	↓ MOL2 SDF SMILES Flexibase

69466585

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-1-(2-methylpyrazol-3-yl)-1-phenyl-butan-1-ol (1S)-1-(2-methylpyrazol-3-yl)-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)	2.43	5.12	-5.15	1	3	0	38	230.311	4	↓ MOL2 SDF SMILES Flexibase

69466588

Analogs

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Popular Name: (1S)-1-(2,4-dichloro-5-fluoro-phenyl)-1-(2-methylpyrazol-3-yl)ethanol (1S)-1-(2,4-dichloro-5-fluoro-ph…

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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	4.3	-5.46	1	3	0	38	289.137	2	↓ MOL2 SDF SMILES Flexibase

69466591

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-(2,4-dichloro-5-fluoro-phenyl)-1-(2-methylpyrazol-3-yl)ethanol (1R)-1-(2,4-dichloro-5-fluoro-ph…

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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	4.59	-5.87	1	3	0	38	289.137	2	↓ MOL2 SDF SMILES Flexibase

69466592

Analogs

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Popular Name: (1S)-1-(4-ethylphenyl)-1-(2-methylpyrazol-3-yl)ethanol (1S)-1-(4-ethylphenyl)-1-(2-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)	2.28	5.25	-6.09	1	3	0	38	230.311	3	↓ MOL2 SDF SMILES Flexibase

69466593

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-(4-ethylphenyl)-1-(2-methylpyrazol-3-yl)ethanol (1R)-1-(4-ethylphenyl)-1-(2-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)	2.28	5.33	-6.05	1	3	0	38	230.311	3	↓ MOL2 SDF SMILES Flexibase

69466594

Analogs

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Popular Name: (1S)-1-(3,4-dimethylphenyl)-1-(2-methylpyrazol-3-yl)ethanol (1S)-1-(3,4-dimethylphenyl)-1-(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)	2.19	5.03	-6.37	1	3	0	38	230.311	2	↓ MOL2 SDF SMILES Flexibase

69466596

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-(3,4-dimethylphenyl)-1-(2-methylpyrazol-3-yl)ethanol (1R)-1-(3,4-dimethylphenyl)-1-(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)	2.19	5.11	-6.26	1	3	0	38	230.311	2	↓ MOL2 SDF SMILES Flexibase

69466597

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-1-(2,5-dimethylphenyl)-1-(2-methylpyrazol-3-yl)ethanol (1S)-1-(2,5-dimethylphenyl)-1-(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)	2.19	4.94	-5.34	1	3	0	38	230.311	2	↓ MOL2 SDF SMILES Flexibase

69466599

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-(2,5-dimethylphenyl)-1-(2-methylpyrazol-3-yl)ethanol (1R)-1-(2,5-dimethylphenyl)-1-(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)	2.19	4.65	-6.02	1	3	0	38	230.311	2	↓ MOL2 SDF SMILES Flexibase

69466611

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (S)-(4-ethoxyphenyl)-(2-methylpyrazol-3-yl)methanol (S)-(4-ethoxyphenyl)-(2-methylpy…

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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)	1.98	3.61	-9.22	1	4	0	47	232.283	4	↓ MOL2 SDF SMILES Flexibase

69466613

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (R)-(4-ethoxyphenyl)-(2-methylpyrazol-3-yl)methanol (R)-(4-ethoxyphenyl)-(2-methylpy…

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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)	1.98	3.57	-9.09	1	4	0	47	232.283	4	↓ MOL2 SDF SMILES Flexibase

69466614

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (S)-(4-isopropoxyphenyl)-(2-methylpyrazol-3-yl)methanol (S)-(4-isopropoxyphenyl)-(2-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)	2.34	4.23	-9.05	1	4	0	47	246.31	4	↓ MOL2 SDF SMILES Flexibase

69466617

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (R)-(4-isopropoxyphenyl)-(2-methylpyrazol-3-yl)methanol (R)-(4-isopropoxyphenyl)-(2-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)	2.34	4.17	-8.97	1	4	0	47	246.31	4	↓ MOL2 SDF SMILES Flexibase

69466618

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (S)-(2-methylpyrazol-3-yl)-(4-propoxyphenyl)methanol (S)-(2-methylpyrazol-3-yl)-(4-pr…

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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)	2.48	4.41	-8.96	1	4	0	47	246.31	5	↓ MOL2 SDF SMILES Flexibase

69466621

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (R)-(2-methylpyrazol-3-yl)-(4-propoxyphenyl)methanol (R)-(2-methylpyrazol-3-yl)-(4-pr…

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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)	2.48	4.36	-8.78	1	4	0	47	246.31	5	↓ MOL2 SDF SMILES Flexibase

69466624

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (S)-(2-ethoxyphenyl)-(2-methylpyrazol-3-yl)methanol (S)-(2-ethoxyphenyl)-(2-methylpy…

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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)	1.93	3.72	-7.91	1	4	0	47	232.283	4	↓ MOL2 SDF SMILES Flexibase

69466626

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (R)-(2-ethoxyphenyl)-(2-methylpyrazol-3-yl)methanol (R)-(2-ethoxyphenyl)-(2-methylpy…

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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)	1.93	3.53	-8.24	1	4	0	47	232.283	4	↓ MOL2 SDF SMILES Flexibase

69466633

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (R)-(5-bromo-2-methoxy-phenyl)-(2-methylpyrazol-3-yl)methanol (R)-(5-bromo-2-methoxy-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)	2.34	3.52	-7.74	1	4	0	47	297.152	3	↓ MOL2 SDF SMILES Flexibase

69466635

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (S)-(5-bromo-2-methoxy-phenyl)-(2-methylpyrazol-3-yl)methanol (S)-(5-bromo-2-methoxy-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)	2.34	3.26	-7.37	1	4	0	47	297.152	3	↓ MOL2 SDF SMILES Flexibase

69466637

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (S)-(3-ethoxyphenyl)-(2-methylpyrazol-3-yl)methanol (S)-(3-ethoxyphenyl)-(2-methylpy…

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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)	1.95	3.59	-8.76	1	4	0	47	232.283	4	↓ MOL2 SDF SMILES Flexibase

69466638

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (R)-(3-ethoxyphenyl)-(2-methylpyrazol-3-yl)methanol (R)-(3-ethoxyphenyl)-(2-methylpy…

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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)	1.95	3.55	-8.72	1	4	0	47	232.283	4	↓ MOL2 SDF SMILES Flexibase

69466640

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (S)-(3-isopropoxyphenyl)-(2-methylpyrazol-3-yl)methanol (S)-(3-isopropoxyphenyl)-(2-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)	2.32	4.23	-8.65	1	4	0	47	246.31	4	↓ MOL2 SDF SMILES Flexibase

69466643

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (R)-(3-isopropoxyphenyl)-(2-methylpyrazol-3-yl)methanol (R)-(3-isopropoxyphenyl)-(2-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)	2.32	4.21	-8.83	1	4	0	47	246.31	4	↓ MOL2 SDF SMILES Flexibase

69466645

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (S)-(2-methylpyrazol-3-yl)-(3-propoxyphenyl)methanol (S)-(2-methylpyrazol-3-yl)-(3-pr…

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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)	2.46	4.4	-8.55	1	4	0	47	246.31	5	↓ MOL2 SDF SMILES Flexibase

69466647

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (R)-(2-methylpyrazol-3-yl)-(3-propoxyphenyl)methanol (R)-(2-methylpyrazol-3-yl)-(3-pr…

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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)	2.46	4.36	-8.49	1	4	0	47	246.31	5	↓ MOL2 SDF SMILES Flexibase

69466648

Analogs

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Popular Name: (R)-(2,5-dimethoxyphenyl)-(2-methylpyrazol-3-yl)methanol (R)-(2,5-dimethoxyphenyl)-(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)	1.59	2.21	-8.97	1	5	0	57	248.282	4	↓ MOL2 SDF SMILES Flexibase

69466649

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (S)-(2,5-dimethoxyphenyl)-(2-methylpyrazol-3-yl)methanol (S)-(2,5-dimethoxyphenyl)-(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)	1.59	1.93	-8.6	1	5	0	57	248.282	4	↓ MOL2 SDF SMILES Flexibase

69466652

Analogs

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Popular Name: (R)-(3,4-dimethoxyphenyl)-(2-methylpyrazol-3-yl)methanol (R)-(3,4-dimethoxyphenyl)-(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)	1.19	2.61	-11.93	1	5	0	57	248.282	4	↓ MOL2 SDF SMILES Flexibase

69466653

Analogs

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Popular Name: (S)-(3,4-dimethoxyphenyl)-(2-methylpyrazol-3-yl)methanol (S)-(3,4-dimethoxyphenyl)-(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)	1.19	2.55	-11.86	1	5	0	57	248.282	4	↓ MOL2 SDF SMILES Flexibase

69466656

Analogs

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Popular Name: (R)-(2-bromo-4,5-dimethoxy-phenyl)-(2-methylpyrazol-3-yl)methanol (R)-(2-bromo-4,5-dimethoxy-pheny…

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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)	1.93	2.96	-9.54	1	5	0	57	327.178	4	↓ MOL2 SDF SMILES Flexibase

69466659

Analogs

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Popular Name: (S)-(2-bromo-4,5-dimethoxy-phenyl)-(2-methylpyrazol-3-yl)methanol (S)-(2-bromo-4,5-dimethoxy-pheny…

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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)	1.93	2.96	-9.6	1	5	0	57	327.178	4	↓ MOL2 SDF SMILES Flexibase

69466661

Analogs

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Popular Name: (R)-(3-bromo-4-methoxy-phenyl)-(2-methylpyrazol-3-yl)methanol (R)-(3-bromo-4-methoxy-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)	2.34	3.36	-10.03	1	4	0	47	297.152	3	↓ MOL2 SDF SMILES Flexibase

69466662

Analogs

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Popular Name: (S)-(3-bromo-4-methoxy-phenyl)-(2-methylpyrazol-3-yl)methanol (S)-(3-bromo-4-methoxy-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)	2.34	3.32	-9.97	1	4	0	47	297.152	3	↓ MOL2 SDF SMILES Flexibase

69466665

Analogs

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Popular Name: (R)-[4-(difluoromethoxy)phenyl]-(2-methylpyrazol-3-yl)methanol (R)-[4-(difluoromethoxy)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)	2.16	2.98	-10.96	1	4	0	47	254.236	4	↓ MOL2 SDF SMILES Flexibase

69466666

Analogs

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Popular Name: (S)-[4-(difluoromethoxy)phenyl]-(2-methylpyrazol-3-yl)methanol (S)-[4-(difluoromethoxy)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)	2.16	2.92	-10.86	1	4	0	47	254.236	4	↓ MOL2 SDF SMILES Flexibase

69466669

Analogs

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Popular Name: (R)-[2-(difluoromethoxy)phenyl]-(2-methylpyrazol-3-yl)methanol (R)-[2-(difluoromethoxy)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)	2.11	3.18	-10.6	1	4	0	47	254.236	4	↓ MOL2 SDF SMILES Flexibase

69466670

Analogs

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Popular Name: (S)-[2-(difluoromethoxy)phenyl]-(2-methylpyrazol-3-yl)methanol (S)-[2-(difluoromethoxy)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)	2.11	2.92	-10.47	1	4	0	47	254.236	4	↓ MOL2 SDF SMILES Flexibase

69466672

Analogs

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Popular Name: (S)-[4-(difluoromethoxy)-3-ethoxy-phenyl]-(2-methylpyrazol-3-yl)methanol (S)-[4-(difluoromethoxy)-3-ethox…

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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)	2.12	3.78	-12.59	1	5	0	57	298.289	6	↓ MOL2 SDF SMILES Flexibase

69466673

Analogs

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Popular Name: (R)-[4-(difluoromethoxy)-3-ethoxy-phenyl]-(2-methylpyrazol-3-yl)methanol (R)-[4-(difluoromethoxy)-3-ethox…

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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)	2.12	3.75	-12.52	1	5	0	57	298.289	6	↓ MOL2 SDF SMILES Flexibase

69466674

Analogs

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Popular Name: (R)-[3-(difluoromethoxy)-4-methoxy-phenyl]-(2-methylpyrazol-3-yl)methanol (R)-[3-(difluoromethoxy)-4-metho…

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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)	1.75	2.9	-12.5	1	5	0	57	284.262	5	↓ MOL2 SDF SMILES Flexibase

69466676

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (S)-[3-(difluoromethoxy)-4-methoxy-phenyl]-(2-methylpyrazol-3-yl)methanol (S)-[3-(difluoromethoxy)-4-metho…

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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)	1.75	2.84	-12.38	1	5	0	57	284.262	5	↓ MOL2 SDF SMILES Flexibase

69466678

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (R)-(2-methylpyrazol-3-yl)-(2,4,6-trimethoxyphenyl)methanol (R)-(2-methylpyrazol-3-yl)-(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)	1.57	2.64	-10.02	1	6	0	66	278.308	5	↓ MOL2 SDF SMILES Flexibase

69466680

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (S)-(2-methylpyrazol-3-yl)-(2,4,6-trimethoxyphenyl)methanol (S)-(2-methylpyrazol-3-yl)-(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)	1.57	2.8	-10.02	1	6	0	66	278.308	5	↓ MOL2 SDF SMILES Flexibase

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SQL Query Was

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