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Quick Search ZINC ID or SMILES

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ZINC Item

Suppliers, Protomers, & Similar Substances

20614233

Analogs

36615304

Draw Identity 99% 90% 80% 70%

Popular Name: N-ethyl-N-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-3,5-dimethyl-1-propyl-pyrazole-4-sulfonamide N-ethyl-N-[(1-ethyl-3,5-dimethyl…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.92	7.54	-15.28	0	7	0	73	381.546	8	↓ MOL2 SDF SMILES Flexibase

20614990

Analogs

20614992
36615280
20602145

Draw Identity 99% 90% 80% 70%

Popular Name: N-ethyl-N-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-1,3,5-trimethyl-pyrazole-4-sulfonamide N-ethyl-N-[(1-ethyl-3,5-dimethyl…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	1.04	5.77	-15.91	0	7	0	73	353.492	6	↓ MOL2 SDF SMILES Flexibase

20614992

Analogs

36615280
20602145
20614990

Draw Identity 99% 90% 80% 70%

Popular Name: N-ethyl-N-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-1,3,5-trimethyl-pyrazole-4-sulfonamide N-ethyl-N-[(1-ethyl-3-methyl-pyr…

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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)	0.82	5.08	-17.15	0	7	0	73	339.465	6	↓ MOL2 SDF SMILES Flexibase

14226411

Analogs

14229738
14229741
14229753

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-N,1,3,5-tetramethyl-pyrazole-4-sulfonamide N-[(1-ethyl-3-methyl-pyrazol-4-y…

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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)	0.45	4.64	-17.32	0	7	0	73	325.438	5	↓ MOL2 SDF SMILES Flexibase

14226414

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-N,1,3-trimethyl-pyrazole-4-sulfonamide N-[(1-ethyl-3-methyl-pyrazol-4-y…

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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)	0.22	3.72	-13.26	0	7	0	73	311.411	5	↓ MOL2 SDF SMILES Flexibase

14226417

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-ethyl-N-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-N,3-dimethyl-pyrazole-4-sulfonamide 1-ethyl-N-[(1-ethyl-3-methyl-pyr…

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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)	0.60	4.61	-16.48	0	7	0	73	325.438	6	↓ MOL2 SDF SMILES Flexibase

14226422

Analogs

14226856
36615248

Draw Identity 99% 90% 80% 70%

Popular Name: 1-ethyl-N-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-N,5-dimethyl-pyrazole-4-sulfonamide 1-ethyl-N-[(1-ethyl-3-methyl-pyr…

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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)	0.60	4.51	-17.56	0	7	0	73	325.438	6	↓ MOL2 SDF SMILES Flexibase

14226425

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-N,1,5-trimethyl-pyrazole-4-sulfonamide N-[(1-ethyl-3-methyl-pyrazol-4-y…

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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)	0.22	3.57	-17.05	0	7	0	73	311.411	5	↓ MOL2 SDF SMILES Flexibase

14226852

Analogs

14229738
14229741
14229753

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-N,1,3,5-tetramethyl-pyrazole-4-sulfonamide N-[(1-ethyl-5-methyl-pyrazol-4-y…

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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)	0.45	4.52	-14.53	0	7	0	73	325.438	5	↓ MOL2 SDF SMILES Flexibase

14226853

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-N,1,3-trimethyl-pyrazole-4-sulfonamide N-[(1-ethyl-5-methyl-pyrazol-4-y…

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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)	0.22	3.58	-14.78	0	7	0	73	311.411	5	↓ MOL2 SDF SMILES Flexibase

14226856

Analogs

36615248
14226422

Draw Identity 99% 90% 80% 70%

Popular Name: 1-ethyl-N-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-N,3-dimethyl-pyrazole-4-sulfonamide 1-ethyl-N-[(1-ethyl-5-methyl-pyr…

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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)	0.60	4.46	-13.9	0	7	0	73	325.438	6	↓ MOL2 SDF SMILES Flexibase

14226860

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-ethyl-N-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-N,5-dimethyl-pyrazole-4-sulfonamide 1-ethyl-N-[(1-ethyl-5-methyl-pyr…

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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)	0.60	4.18	-15.02	0	7	0	73	325.438	6	↓ MOL2 SDF SMILES Flexibase

14226862

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-N,1,5-trimethyl-pyrazole-4-sulfonamide N-[(1-ethyl-5-methyl-pyrazol-4-y…

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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)	0.22	3.44	-15.99	0	7	0	73	311.411	5	↓ MOL2 SDF SMILES Flexibase

14226985

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1-ethylpyrazol-4-yl)methyl]-N,1,3,5-tetramethyl-pyrazole-4-sulfonamide N-[(1-ethylpyrazol-4-yl)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)	0.22	3.98	-17.2	0	7	0	73	311.411	5	↓ MOL2 SDF SMILES Flexibase

14226988

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1-ethylpyrazol-4-yl)methyl]-N,1,3-trimethyl-pyrazole-4-sulfonamide N-[(1-ethylpyrazol-4-yl)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)	0.00	3.29	-17.49	0	7	0	73	297.384	5	↓ MOL2 SDF SMILES Flexibase

14226992

Analogs

36615342

Draw Identity 99% 90% 80% 70%

Popular Name: 1-ethyl-N-[(1-ethylpyrazol-4-yl)methyl]-N,3-dimethyl-pyrazole-4-sulfonamide 1-ethyl-N-[(1-ethylpyrazol-4-yl)…

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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)	0.38	4.15	-17.31	0	7	0	73	311.411	6	↓ MOL2 SDF SMILES Flexibase

14227001

Analogs

36615332
36615342
37839984

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1-ethylpyrazol-4-yl)methyl]-N,1,5-trimethyl-pyrazole-4-sulfonamide N-[(1-ethylpyrazol-4-yl)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)	0.00	3.16	-19.1	0	7	0	73	297.384	5	↓ MOL2 SDF SMILES Flexibase

14229738

Analogs

14229741
14229753
14226411
14226852

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-N,1,3,5-tetramethyl-pyrazole-4-sulfonamide N-[(1-ethyl-3,5-dimethyl-pyrazol…

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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)	0.67	4.92	-16	0	7	0	73	339.465	5	↓ MOL2 SDF SMILES Flexibase

14229741

Analogs

14229753
14226411
14226852
14229738

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-N,1,3-trimethyl-pyrazole-4-sulfonamide N-[(1-ethyl-3,5-dimethyl-pyrazol…

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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)	0.45	3.88	-14.06	0	7	0	73	325.438	5	↓ MOL2 SDF SMILES Flexibase

14229744

Analogs

14229750
20602551
36614544

Draw Identity 99% 90% 80% 70%

Popular Name: 1-ethyl-N-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-N,3-dimethyl-pyrazole-4-sulfonamide 1-ethyl-N-[(1-ethyl-3,5-dimethyl…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	0.82	4.99	-16.07	0	7	0	73	339.465	6	↓ MOL2 SDF SMILES Flexibase

14229750

Analogs

20602551
36614544
36615248
14229744

Draw Identity 99% 90% 80% 70%

Popular Name: 1-ethyl-N-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-N,5-dimethyl-pyrazole-4-sulfonamide 1-ethyl-N-[(1-ethyl-3,5-dimethyl…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	0.82	4.64	-15.54	0	7	0	73	339.465	6	↓ MOL2 SDF SMILES Flexibase

14229753

Analogs

14226411
14226852
14229738
14229741

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-N,1,5-trimethyl-pyrazole-4-sulfonamide N-[(1-ethyl-3,5-dimethyl-pyrazol…

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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)	0.45	4.04	-18.22	0	7	0	73	325.438	5	↓ MOL2 SDF SMILES Flexibase

14248289

Analogs

14248291

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R)-1-(1,5-dimethylpyrazol-4-yl)ethyl]-1,3,5-trimethyl-pyrazole-4-sulfonamide N-[(1R)-1-(1,5-dimethylpyrazol-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)	0.38	2.29	-16.35	1	7	0	82	311.411	4	↓ MOL2 SDF SMILES Flexibase

14248291

Analogs

14248289

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S)-1-(1,5-dimethylpyrazol-4-yl)ethyl]-1,3,5-trimethyl-pyrazole-4-sulfonamide N-[(1S)-1-(1,5-dimethylpyrazol-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)	0.38	2.31	-16.35	1	7	0	82	311.411	4	↓ MOL2 SDF SMILES Flexibase

14249231

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1,3,5-trimethyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazole-4-sulfonamide 1,3,5-trimethyl-N-[(1-methylpyra…

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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)	-0.40	1.29	-14.4	1	7	0	82	283.357	4	↓ MOL2 SDF SMILES Flexibase

14249946

Analogs

14250031
14250113
14250115
14250122

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1,3-dimethylpyrazol-4-yl)methyl]-N,1,3,5-tetramethyl-pyrazole-4-sulfonamide N-[(1,3-dimethylpyrazol-4-yl)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)	0.07	3.77	-17.43	0	7	0	73	311.411	4	↓ MOL2 SDF SMILES Flexibase

14249947

Analogs

37839984

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1,3-dimethylpyrazol-4-yl)methyl]-N,1,3-trimethyl-pyrazole-4-sulfonamide N-[(1,3-dimethylpyrazol-4-yl)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)	-0.15	2.86	-13.71	0	7	0	73	297.384	4	↓ MOL2 SDF SMILES Flexibase

14249949

Analogs

36615241
36615248

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1,3-dimethylpyrazol-4-yl)methyl]-1-ethyl-N,3-dimethyl-pyrazole-4-sulfonamide N-[(1,3-dimethylpyrazol-4-yl)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)	0.22	3.72	-13.39	0	7	0	73	311.411	5	↓ MOL2 SDF SMILES Flexibase

14249951

Analogs

36615241
36615342

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1,3-dimethylpyrazol-4-yl)methyl]-1-ethyl-N,5-dimethyl-pyrazole-4-sulfonamide N-[(1,3-dimethylpyrazol-4-yl)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)	0.22	3.44	-16.78	0	7	0	73	311.411	5	↓ MOL2 SDF SMILES Flexibase

14249953

Analogs

6527363

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1,3-dimethylpyrazol-4-yl)methyl]-N,1,5-trimethyl-pyrazole-4-sulfonamide N-[(1,3-dimethylpyrazol-4-yl)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)	-0.15	2.71	-17.38	0	7	0	73	297.384	4	↓ MOL2 SDF SMILES Flexibase

14250031

Analogs

14250113
14250115
14250122
14249946

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1,5-dimethylpyrazol-4-yl)methyl]-N,1,3,5-tetramethyl-pyrazole-4-sulfonamide N-[(1,5-dimethylpyrazol-4-yl)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)	0.07	3.63	-14.72	0	7	0	73	311.411	4	↓ MOL2 SDF SMILES Flexibase

14250037

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1,5-dimethylpyrazol-4-yl)methyl]-1-ethyl-N,5-dimethyl-pyrazole-4-sulfonamide N-[(1,5-dimethylpyrazol-4-yl)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)	0.22	3.27	-15.42	0	7	0	73	311.411	5	↓ MOL2 SDF SMILES Flexibase

14250039

Analogs

36615332
37839984

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1,5-dimethylpyrazol-4-yl)methyl]-N,1,5-trimethyl-pyrazole-4-sulfonamide N-[(1,5-dimethylpyrazol-4-yl)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)	-0.15	2.56	-16.34	0	7	0	73	297.384	4	↓ MOL2 SDF SMILES Flexibase

14250113

Analogs

14250115
14250122
14249946
14250031

Draw Identity 99% 90% 80% 70%

Popular Name: N,1,3,5-tetramethyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrazole-4-sulfonamide N,1,3,5-tetramethyl-N-[(1,3,5-tr…

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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)	0.29	3.87	-15.85	0	7	0	73	325.438	4	↓ MOL2 SDF SMILES Flexibase

14250115

Analogs

14250122
14249946
14250031
14250113

Draw Identity 99% 90% 80% 70%

Popular Name: N,1,3-trimethyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrazole-4-sulfonamide N,1,3-trimethyl-N-[(1,3,5-trimet…

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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)	0.07	3.09	-15.79	0	7	0	73	311.411	4	↓ MOL2 SDF SMILES Flexibase

14250117

Analogs

20602549
20602550
20602567
36615304

Draw Identity 99% 90% 80% 70%

Popular Name: 1-ethyl-N,3-dimethyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrazole-4-sulfonamide 1-ethyl-N,3-dimethyl-N-[(1,3,5-t…

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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)	0.45	3.95	-15.56	0	7	0	73	325.438	5	↓ MOL2 SDF SMILES Flexibase

14250120

Analogs

20602549
20602550
20602567

Draw Identity 99% 90% 80% 70%

Popular Name: 1-ethyl-N,5-dimethyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrazole-4-sulfonamide 1-ethyl-N,5-dimethyl-N-[(1,3,5-t…

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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)	0.45	3.77	-15.72	0	7	0	73	325.438	5	↓ MOL2 SDF SMILES Flexibase

14250122

Analogs

14249946
14250031
14250113
14250115

Draw Identity 99% 90% 80% 70%

Popular Name: N,1,5-trimethyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrazole-4-sulfonamide N,1,5-trimethyl-N-[(1,3,5-trimet…

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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)	0.07	3	-17.85	0	7	0	73	311.411	4	↓ MOL2 SDF SMILES Flexibase

2803506

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-ethyl-N-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-5-methyl-pyrazole-4-sulfonamide 1-ethyl-N-[(1-ethyl-5-methyl-pyr…

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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)	0.35	2.73	-17	1	7	0	82	311.411	6	↓ MOL2 SDF SMILES Flexibase

2803528

Analogs

36615342

Draw Identity 99% 90% 80% 70%

Popular Name: 1-ethyl-N-[(1-ethylpyrazol-4-yl)methyl]-5-methyl-pyrazole-4-sulfonamide 1-ethyl-N-[(1-ethylpyrazol-4-yl)…

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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)	0.13	-3.65	-14.93	1	7	0	81	297.384	6	↓ MOL2 SDF SMILES Flexibase

2803626

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1,5-dimethylpyrazol-4-yl)methyl]-1-ethyl-5-methyl-pyrazole-4-sulfonamide N-[(1,5-dimethylpyrazol-4-yl)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)	-0.02	-3.71	-17.25	1	7	0	81	297.384	5	↓ MOL2 SDF SMILES Flexibase

2803716

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-1,3-dimethyl-pyrazole-4-sulfonamide N-[(1-ethyl-5-methyl-pyrazol-4-y…

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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)	-0.02	-3.8	-15.54	1	7	0	81	297.384	5	↓ MOL2 SDF SMILES Flexibase

69702298

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1,3,5-trimethyl-N-[(1-methylpyrazol-4-yl)methyl]-N-propyl-pyrazole-4-sulfonamide 1,3,5-trimethyl-N-[(1-methylpyra…

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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)	0.73	4.63	-14.41	0	7	0	73	325.438	6	↓ MOL2 SDF SMILES Flexibase

69763394

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-methyl-N-(1H-pyrazol-4-ylmethyl)-1H-pyrazole-4-sulfonamide N-methyl-N-(1H-pyrazol-4-ylmethy…

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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)	-0.73	-0.67	-16.1	2	7	0	95	241.276	4	↓ MOL2 SDF SMILES Flexibase

40346785

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-amino-N,1-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazole-4-sulfonamide 3-amino-N,1-dimethyl-N-[(1-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)	-0.99	0.94	-15.61	2	8	0	99	284.345	4	↓ MOL2 SDF SMILES Flexibase

40346786

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-amino-1-ethyl-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazole-4-sulfonamide 3-amino-1-ethyl-N-methyl-N-[(1-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)	-0.61	1.73	-15.75	2	8	0	99	298.372	5	↓ MOL2 SDF SMILES Flexibase

40346787

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-amino-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]-1-propyl-pyrazole-4-sulfonamide 3-amino-N-methyl-N-[(1-methylpyr…

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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)	-0.11	2.48	-15.42	2	8	0	99	312.399	6	↓ MOL2 SDF SMILES Flexibase

40347169

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-amino-1-methyl-N-(1H-pyrazol-4-ylmethyl)pyrazole-4-sulfonamide 3-amino-1-methyl-N-(1H-pyrazol-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)	-1.30	-2.28	-15.05	4	8	0	119	256.291	4	↓ MOL2 SDF SMILES Flexibase

40347170

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-amino-1-ethyl-N-(1H-pyrazol-4-ylmethyl)pyrazole-4-sulfonamide 3-amino-1-ethyl-N-(1H-pyrazol-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)	-0.93	-1.42	-14.8	4	8	0	119	270.318	5	↓ MOL2 SDF SMILES Flexibase

40347171

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-amino-1-propyl-N-(1H-pyrazol-4-ylmethyl)pyrazole-4-sulfonamide 3-amino-1-propyl-N-(1H-pyrazol-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)	-0.42	-0.66	-14.39	4	8	0	119	284.345	6	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

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filter.purchasability = annotated
page.format = targets
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SQL Query Was

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