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ZINC Item

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7723253

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[5-[(2-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-methyl-benzamide N-[5-[(2-fluorophenyl)methylsulf…

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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	0.51	-15.88	1	4	0	54	359.451	5	↓ MOL2 SDF SMILES Flexibase

7723255

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[5-[(2-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2-methyl-benzamide N-[5-[(2-fluorophenyl)methylsulf…

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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	0.44	-15.07	1	4	0	54	359.451	5	↓ MOL2 SDF SMILES Flexibase

7723257

Analogs

39723798
6237383
6237380
6237379

Draw Identity 99% 90% 80% 70%

Popular Name: 3-fluoro-N-[5-[(2-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-benzamide 3-fluoro-N-[5-[(2-fluorophenyl)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)	4.12	0.93	-14.26	1	4	0	54	363.414	5	↓ MOL2 SDF SMILES Flexibase

7723260

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[5-[(2-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2,3-dimethyl-benzamide N-[5-[(2-fluorophenyl)methylsulf…

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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)	4.78	0.68	-15.03	1	4	0	54	373.478	5	↓ MOL2 SDF SMILES Flexibase

7723261

Analogs

39885497
39885498

Draw Identity 99% 90% 80% 70%

Popular Name: N-[5-[(2-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3,4-dimethoxy-benzamide N-[5-[(2-fluorophenyl)methylsulf…

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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	0.56	-18.99	1	6	0	73	405.476	7	↓ MOL2 SDF SMILES Flexibase

7723280

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-isopropoxy-N-[5-(p-tolylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-benzamide 4-isopropoxy-N-[5-(p-tolylmethyl…

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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)	5.11	0.15	-14.14	1	5	0	64	399.541	7	↓ MOL2 SDF SMILES Flexibase

7723281

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-fluoro-N-[5-(p-tolylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-benzamide 4-fluoro-N-[5-(p-tolylmethylsulf…

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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)	4.47	0.55	-13.81	1	4	0	54	359.451	5	↓ MOL2 SDF SMILES Flexibase

7723285

Analogs

44719595
3397557
3417357

Draw Identity 99% 90% 80% 70%

Popular Name: N-[5-(p-tolylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide N-[5-(p-tolylmethylsulfanyl)-1,3…

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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)	4.31	-0.19	-14.52	1	4	0	54	341.461	5	↓ MOL2 SDF SMILES Flexibase

7723289

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-methyl-N-[5-(p-tolylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-benzamide 2-methyl-N-[5-(p-tolylmethylsulf…

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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)	4.71	0.06	-13.46	1	4	0	54	355.488	5	↓ MOL2 SDF SMILES Flexibase

7723293

Analogs

7344832

Draw Identity 99% 90% 80% 70%

Popular Name: 3,4-dimethoxy-N-[5-(p-tolylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-benzamide 3,4-dimethoxy-N-[5-(p-tolylmethy…

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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)	3.96	0.18	-17.32	1	6	0	73	401.513	7	↓ MOL2 SDF SMILES Flexibase

7723294

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-methoxy-4-methylsulfanyl-N-[5-(p-tolylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-benzamide 2-methoxy-4-methylsulfanyl-N-[5-…

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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)	5.28	0.06	-18.24	1	5	0	64	417.581	7	↓ MOL2 SDF SMILES Flexibase

13011606

Analogs

14634633
8061075

Draw Identity 99% 90% 80% 70%

Popular Name: 2-bromo-4-fluoro-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide 2-bromo-4-fluoro-N-[5-[(4-fluoro…

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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	9.95	-15.15	1	4	0	55	442.31	5	↓ MOL2 SDF SMILES Flexibase

37077681

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-2,5-dimethoxy-benzamide N-(5-benzylsulfanyl-1,3,4-thiadi…

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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	8.99	-16.62	1	6	0	73	387.486	7	↓ MOL2 SDF SMILES Flexibase

14581549

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3,5-difluoro-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide 3,5-difluoro-N-[5-[(4-fluorophen…

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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)	4.28	9.38	-13.13	1	4	0	55	381.404	5	↓ MOL2 SDF SMILES Flexibase

14581551

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-methyl-3-nitro-benzamide N-[5-[(4-fluorophenyl)methylsulf…

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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)	4.36	10.57	-22.09	1	7	0	101	404.448	6	↓ MOL2 SDF SMILES Flexibase

14581602

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(difluoromethoxy)-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide 2-(difluoromethoxy)-N-[5-[(4-flu…

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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)	5.14	10.03	-18.11	1	5	0	64	411.43	7	↓ MOL2 SDF SMILES Flexibase

14581827

Analogs

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Popular Name: ethyl ethyl

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.46	11.52	-16.07	1	9	0	127	462.484	9	↓ MOL2 SDF SMILES Flexibase

14581916

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-chloro-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3-nitro-benzamide 4-chloro-N-[5-[(4-fluorophenyl)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)	4.59	10.32	-21.41	1	7	0	101	424.866	6	↓ MOL2 SDF SMILES Flexibase

14581918

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-bromo-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide 4-bromo-N-[5-[(4-fluorophenyl)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)	4.83	9.87	-13.82	1	4	0	55	424.32	5	↓ MOL2 SDF SMILES Flexibase

14581927

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3,4,5-triethoxy-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide 3,4,5-triethoxy-N-[5-[(4-fluorop…

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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)	4.78	11.2	-16.29	1	7	0	83	477.583	11	↓ MOL2 SDF SMILES Flexibase

14581933

Analogs

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Popular Name: 2,4-dichloro-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide 2,4-dichloro-N-[5-[(4-fluorophen…

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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	10.27	-15.2	1	4	0	55	414.314	5	↓ MOL2 SDF SMILES Flexibase

14581935

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3,4-dichloro-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide 3,4-dichloro-N-[5-[(4-fluorophen…

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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	10.21	-15.38	1	4	0	55	414.314	5	↓ MOL2 SDF SMILES Flexibase

14581953

Analogs

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Popular Name: 3-(diethylsulfamoyl)-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide 3-(diethylsulfamoyl)-N-[5-[(4-fl…

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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)	4.07	8.95	-22.48	1	7	0	92	480.612	9	↓ MOL2 SDF SMILES Flexibase

14581960

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3,4,5-trimethoxy-benzamide N-[5-[(4-fluorophenyl)methylsulf…

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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)	3.66	8.41	-16.91	1	7	0	83	435.502	8	↓ MOL2 SDF SMILES Flexibase

14581972

Analogs

39723878
39723879
39723880
39723881
39723882

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Popular Name: 2,6-difluoro-N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide 2,6-difluoro-N-[5-[(4-fluorophen…

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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)	4.26	9.2	-16.98	1	4	0	55	381.404	5	↓ MOL2 SDF SMILES Flexibase

14582014

Analogs

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Popular Name: N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-methoxy-3-nitro-benzamide N-[5-[(4-fluorophenyl)methylsulf…

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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)	3.97	10	-25.02	1	8	0	110	420.447	7	↓ MOL2 SDF SMILES Flexibase

14582257

Analogs

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Popular Name: 2-bromo-N-[5-[(2,6-dichlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide 2-bromo-N-[5-[(2,6-dichloropheny…

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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)	5.88	10.66	-17.07	1	4	0	55	475.22	5	↓ MOL2 SDF SMILES Flexibase

14582259

Analogs

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Popular Name: 2-chloro-N-[5-[(2,6-dichlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide 2-chloro-N-[5-[(2,6-dichlorophen…

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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)	5.75	10.55	-17.56	1	4	0	55	430.769	5	↓ MOL2 SDF SMILES Flexibase

14582269

Analogs

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Popular Name: N-[5-[(2,6-dichlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2-fluoro-benzamide N-[5-[(2,6-dichlorophenyl)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)	5.24	10.11	-20.09	1	4	0	55	414.314	5	↓ MOL2 SDF SMILES Flexibase

14582297

Analogs

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Popular Name: N-[5-[(2,6-dichlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-3-fluoro-benzamide N-[5-[(2,6-dichlorophenyl)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)	5.26	10.1	-13.84	1	4	0	55	414.314	5	↓ MOL2 SDF SMILES Flexibase

14582314

Analogs

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Popular Name: methyl 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)	5.18	11.39	-17.03	1	9	0	127	499.357	8	↓ MOL2 SDF SMILES Flexibase

14582321

Analogs

8860157

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Popular Name: N-[5-[(2,6-dichlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2-methyl-3-nitro-benzamide N-[5-[(2,6-dichlorophenyl)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)	5.43	11.24	-20.79	1	7	0	101	455.348	6	↓ MOL2 SDF SMILES Flexibase

14582392

Analogs

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Popular Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-3-methyl-2-nitro-benzamide N-(5-benzylsulfanyl-1,3,4-thiadi…

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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	11.74	-26.97	1	7	0	101	386.458	6	↓ MOL2 SDF SMILES Flexibase

14582460

Analogs

39724027

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Popular Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-3-bromo-4-ethoxy-5-methoxy-benzamide N-(5-benzylsulfanyl-1,3,4-thiadi…

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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	10.12	-13.21	1	6	0	73	480.409	8	↓ MOL2 SDF SMILES Flexibase

14582472

Analogs

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Popular Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-2-bromo-5-methoxy-benzamide N-(5-benzylsulfanyl-1,3,4-thiadi…

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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)	4.65	9.1	-14.01	1	5	0	64	436.356	6	↓ MOL2 SDF SMILES Flexibase

14582520

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-2-(difluoromethoxy)benzamide N-(5-benzylsulfanyl-1,3,4-thiadi…

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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)	4.97	9.96	-17.74	1	5	0	64	393.44	7	↓ MOL2 SDF SMILES Flexibase

14582668

Analogs

39723912
39723914
39723915
39723916
39723976

Draw Identity 99% 90% 80% 70%

Popular Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-2-(trifluoromethyl)benzamide N-(5-benzylsulfanyl-1,3,4-thiadi…

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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)	4.71	10.21	-19.29	1	4	0	55	395.431	6	↓ MOL2 SDF SMILES Flexibase

14582673

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-acetamido-N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide 4-acetamido-N-(5-benzylsulfanyl-…

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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)	3.08	8.09	-17.94	2	6	0	84	384.486	6	↓ MOL2 SDF SMILES Flexibase

14582675

Analogs

35910299
39723752
5904111
6237423
6237380

Draw Identity 99% 90% 80% 70%

Popular Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-4-isopropyl-benzamide N-(5-benzylsulfanyl-1,3,4-thiadi…

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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)	5.37	11.09	-13.75	1	4	0	55	369.515	6	↓ MOL2 SDF SMILES Flexibase

14582677

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-2-iodo-benzamide N-(5-benzylsulfanyl-1,3,4-thiadi…

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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	10.25	-14.65	1	4	0	55	453.33	5	↓ MOL2 SDF SMILES Flexibase

14582679

Analogs

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Popular Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-4-chloro-3-(diethylsulfamoyl)benzamide N-(5-benzylsulfanyl-1,3,4-thiadi…

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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)	4.53	9.59	-19.76	1	7	0	92	497.067	9	↓ MOL2 SDF SMILES Flexibase

14582680

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-3-iodo-benzamide N-(5-benzylsulfanyl-1,3,4-thiadi…

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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)	4.92	10.28	-11.92	1	4	0	55	453.33	5	↓ MOL2 SDF SMILES Flexibase

14582682

Analogs

39723802
39723804
39723848
39723932
39723933

Draw Identity 99% 90% 80% 70%

Popular Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-2,3-dichloro-benzamide N-(5-benzylsulfanyl-1,3,4-thiadi…

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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)	5.12	10.15	-17.57	1	4	0	55	396.324	5	↓ MOL2 SDF SMILES Flexibase

14582684

Analogs

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Popular Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-3,5-dichloro-benzamide N-(5-benzylsulfanyl-1,3,4-thiadi…

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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)	5.15	10.2	-12.06	1	4	0	55	396.324	5	↓ MOL2 SDF SMILES Flexibase

14582685

Analogs

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Popular Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-2,5-dimethyl-benzamide N-(5-benzylsulfanyl-1,3,4-thiadi…

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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)	4.69	10.53	-12.93	1	4	0	55	355.488	5	↓ MOL2 SDF SMILES Flexibase

14582695

Analogs

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Popular Name: methyl 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)	3.92	10.52	-15.95	1	9	0	127	430.467	8	↓ MOL2 SDF SMILES Flexibase

14582702

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-4-(trifluoromethoxy)benzamide N-(5-benzylsulfanyl-1,3,4-thiadi…

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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	8.99	-12.92	1	5	0	64	411.43	7	↓ MOL2 SDF SMILES Flexibase

14582710

Analogs

3413482
3432324

Draw Identity 99% 90% 80% 70%

Popular Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-2-chloro-4,5-difluoro-benzamide N-(5-benzylsulfanyl-1,3,4-thiadi…

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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)	4.72	9.82	-12.74	1	4	0	55	397.859	5	↓ MOL2 SDF SMILES Flexibase

69252325

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-2-isopropylsulfanyl-benzamide N-(5-benzylsulfanyl-1,3,4-thiadi…

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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)	4.99	11.47	-16.66	1	4	0	55	401.582	7	↓ MOL2 SDF SMILES Flexibase

67981609

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-4-(dimethylaminomethyl)benzamide N-(5-benzylsulfanyl-1,3,4-thiadi…

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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)	3.66	11.07	-53.16	2	5	1	59	385.538	7	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	3.66	8.6	-13.89	1	5	0	58	384.53	7	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

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filter.purchasability = annotated
page.format = targets
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Structural Results Found: (before additional filtering)

SQL Query Was

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