ZINC 12

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ZINC Item

Suppliers, Protomers, & Similar Substances

11986747

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2,5-dichlorophenoxy)-N-(4,5,6,7-tetrahydrobenzothiazol-2-yl)acetamide 2-(2,5-dichlorophenoxy)-N-(4,5,6…

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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	-1.51	-12.85	1	4	0	51	357.262	4	↓ MOL2 SDF SMILES Flexibase

20894588

Analogs

33591786
40934648
4071011
6342511

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4-tert-butylphenoxy)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide 2-(4-tert-butylphenoxy)-N-(4,5,6…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.80	10.62	-19.52	1	4	0	51	344.48	5	↓ MOL2 SDF SMILES Flexibase

20897314

Analogs

20897316
20897385
20897388
33591786

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4-methylphenoxy)-N-[(6R)-6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]acetamide 2-(4-methylphenoxy)-N-[(6R)-6-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)	4.01	9.56	-19.46	1	4	0	51	316.426	4	↓ MOL2 SDF SMILES Flexibase

20897316

Analogs

20897385
20897388
33591786
20897314

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4-methylphenoxy)-N-[(6S)-6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]acetamide 2-(4-methylphenoxy)-N-[(6S)-6-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)	4.01	9.56	-19.47	1	4	0	51	316.426	4	↓ MOL2 SDF SMILES Flexibase

20897324

Analogs

20897327
11917333
11917335

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4-chloro-3,5-dimethyl-phenoxy)-N-[(6R)-6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]acetamid 2-(4-chloro-3,5-dimethyl-phenoxy…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.00	10.61	-19.29	1	4	0	51	364.898	4	↓ MOL2 SDF SMILES Flexibase

20897327

Analogs

20897324
11917333

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4-chloro-3,5-dimethyl-phenoxy)-N-[(6S)-6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]acetamid 2-(4-chloro-3,5-dimethyl-phenoxy…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.00	10.61	-19.29	1	4	0	51	364.898	4	↓ MOL2 SDF SMILES Flexibase

20897330

Analogs

20897333
20897424
20897427
6995099
6995100

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(3,5-dimethylphenoxy)-N-[(6R)-6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]acetamide 2-(3,5-dimethylphenoxy)-N-[(6R)-…

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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)	4.39	10.21	-19.61	1	4	0	51	330.453	4	↓ MOL2 SDF SMILES Flexibase

20897333

Analogs

20897424
20897427
6995099
6995100

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(3,5-dimethylphenoxy)-N-[(6S)-6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]acetamide 2-(3,5-dimethylphenoxy)-N-[(6S)-…

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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)	4.39	10.21	-19.61	1	4	0	51	330.453	4	↓ MOL2 SDF SMILES Flexibase

20897341

Analogs

20897342
20897466
20897469
8586751

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4-isopropylphenoxy)-N-[(6R)-6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]acetamide 2-(4-isopropylphenoxy)-N-[(6R)-6…

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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)	5.08	10.84	-19.08	1	4	0	51	344.48	5	↓ MOL2 SDF SMILES Flexibase

20897342

Analogs

20897466
20897469
8586751

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4-isopropylphenoxy)-N-[(6S)-6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]acetamide 2-(4-isopropylphenoxy)-N-[(6S)-6…

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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)	5.08	10.84	-19.09	1	4	0	51	344.48	5	↓ MOL2 SDF SMILES Flexibase

20897345

Analogs

20897348
6342543

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2-isopropyl-5-methyl-phenoxy)-N-[(6R)-6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]acetamide 2-(2-isopropyl-5-methyl-phenoxy)…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.98	11.55	-18.95	1	4	0	51	358.507	5	↓ MOL2 SDF SMILES Flexibase

20897348

Analogs

6342543
20897345

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2-isopropyl-5-methyl-phenoxy)-N-[(6S)-6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]acetamide 2-(2-isopropyl-5-methyl-phenoxy)…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.98	11.55	-18.95	1	4	0	51	358.507	5	↓ MOL2 SDF SMILES Flexibase

20897379

Analogs

20897382
20897419
20897421
6795063
6795737

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(6R)-6-tert-butyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-2-phenoxy-acetamide N-[(6R)-6-tert-butyl-4,5,6,7-tet…

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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	10.35	-19.08	1	4	0	51	344.48	5	↓ MOL2 SDF SMILES Flexibase

20897382

Analogs

20897419
20897421
6795063
6795737

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(6S)-6-tert-butyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-2-phenoxy-acetamide N-[(6S)-6-tert-butyl-4,5,6,7-tet…

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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	10.35	-19.1	1	4	0	51	344.48	5	↓ MOL2 SDF SMILES Flexibase

20897385

Analogs

20897388
33591786
20897314
20897316

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(6R)-6-tert-butyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-2-(4-methylphenoxy)acetamide N-[(6R)-6-tert-butyl-4,5,6,7-tet…

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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)	5.34	11.02	-19.07	1	4	0	51	358.507	5	↓ MOL2 SDF SMILES Flexibase

20897388

Analogs

20897314
20897316

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(6S)-6-tert-butyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-2-(4-methylphenoxy)acetamide N-[(6S)-6-tert-butyl-4,5,6,7-tet…

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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)	5.34	11.02	-19.05	1	4	0	51	358.507	5	↓ MOL2 SDF SMILES Flexibase

20897391

Analogs

20897394
6995091
6995092

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(6R)-6-tert-butyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-2-(2-methylphenoxy)acetamide N-[(6R)-6-tert-butyl-4,5,6,7-tet…

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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)	5.29	11.05	-18.74	1	4	0	51	358.507	5	↓ MOL2 SDF SMILES Flexibase

20897394

Analogs

6995091
6995092

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(6S)-6-tert-butyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-2-(2-methylphenoxy)acetamide N-[(6S)-6-tert-butyl-4,5,6,7-tet…

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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)	5.29	11.05	-18.76	1	4	0	51	358.507	5	↓ MOL2 SDF SMILES Flexibase

20897419

Analogs

20897421
6995097
6995098

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(6R)-6-tert-butyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-2-(4-methoxyphenoxy)acetamide N-[(6R)-6-tert-butyl-4,5,6,7-tet…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.95	9.65	-20.34	1	5	0	60	374.506	6	↓ MOL2 SDF SMILES Flexibase

20897421

Analogs

6995097
6995098

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(6S)-6-tert-butyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-2-(4-methoxyphenoxy)acetamide N-[(6S)-6-tert-butyl-4,5,6,7-tet…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.95	9.65	-20.34	1	5	0	60	374.506	6	↓ MOL2 SDF SMILES Flexibase

20897424

Analogs

20897427
27583389
27583392
6995099
6995100

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(6R)-6-tert-butyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-2-(3-methylphenoxy)acetamide N-[(6R)-6-tert-butyl-4,5,6,7-tet…

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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)	5.32	11.02	-19.28	1	4	0	51	358.507	5	↓ MOL2 SDF SMILES Flexibase

20897427

Analogs

27583389
27583392
6995099
6995100

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(6S)-6-tert-butyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-2-(3-methylphenoxy)acetamide N-[(6S)-6-tert-butyl-4,5,6,7-tet…

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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)	5.32	11.02	-19.28	1	4	0	51	358.507	5	↓ MOL2 SDF SMILES Flexibase

20897431

Analogs

20897435
59318104
59318107
11428406
11428410

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(6R)-6-tert-butyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-2-(4-nitrophenoxy)acetamide N-[(6R)-6-tert-butyl-4,5,6,7-tet…

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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)	4.85	10.95	-20.69	1	7	0	97	389.477	6	↓ MOL2 SDF SMILES Flexibase

20897435

Analogs

59318104
59318107
20897431
11428406

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(6S)-6-tert-butyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-2-(4-nitrophenoxy)acetamide N-[(6S)-6-tert-butyl-4,5,6,7-tet…

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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)	4.85	10.95	-20.69	1	7	0	97	389.477	6	↓ MOL2 SDF SMILES Flexibase

20897439

Analogs

20897443
356000

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(6R)-6-tert-butyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-2-(2-chlorophenoxy)acetamide N-[(6R)-6-tert-butyl-4,5,6,7-tet…

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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)	5.52	10.89	-21.53	1	4	0	51	378.925	5	↓ MOL2 SDF SMILES Flexibase

20897443

Analogs

356000

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(6S)-6-tert-butyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-2-(2-chlorophenoxy)acetamide N-[(6S)-6-tert-butyl-4,5,6,7-tet…

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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)	5.52	10.89	-21.54	1	4	0	51	378.925	5	↓ MOL2 SDF SMILES Flexibase

20897454

Analogs

20897457
6342511
6995095

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(6R)-6-tert-butyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-2-(3,4-dimethylphenoxy)acetamide N-[(6R)-6-tert-butyl-4,5,6,7-tet…

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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)	5.72	11.69	-19.32	1	4	0	51	372.534	5	↓ MOL2 SDF SMILES Flexibase

20897457

Analogs

6342511
6995095

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(6S)-6-tert-butyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-2-(3,4-dimethylphenoxy)acetamide N-[(6S)-6-tert-butyl-4,5,6,7-tet…

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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)	5.72	11.69	-19.32	1	4	0	51	372.534	5	↓ MOL2 SDF SMILES Flexibase

20897466

Analogs

20897469
8586751

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(6R)-6-tert-butyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-2-(4-ethylphenoxy)acetamide N-[(6R)-6-tert-butyl-4,5,6,7-tet…

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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)	5.81	11.79	-18.81	1	4	0	51	372.534	6	↓ MOL2 SDF SMILES Flexibase

20897469

Analogs

8586751

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(6S)-6-tert-butyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-2-(4-ethylphenoxy)acetamide N-[(6S)-6-tert-butyl-4,5,6,7-tet…

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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)	5.81	11.79	-18.83	1	4	0	51	372.534	6	↓ MOL2 SDF SMILES Flexibase

20897472

Analogs

20897475
11917353
11917355

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Popular Name: N-[(6R)-6-tert-butyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-2-(3-chlorophenoxy)acetamide N-[(6R)-6-tert-butyl-4,5,6,7-tet…

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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)	5.55	10.87	-20.54	1	4	0	51	378.925	5	↓ MOL2 SDF SMILES Flexibase

20897475

Analogs

20897472
11917353

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(6S)-6-tert-butyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-2-(3-chlorophenoxy)acetamide N-[(6S)-6-tert-butyl-4,5,6,7-tet…

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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)	5.55	10.87	-20.55	1	4	0	51	378.925	5	↓ MOL2 SDF SMILES Flexibase

1791432

Analogs

6342519
7642530

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(3-methylphenoxy)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide 2-(3-methylphenoxy)-N-(4,5,6,7-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)	3.52	-0.81	-17.78	1	4	0	51	302.399	4	↓ MOL2 SDF SMILES Flexibase

49551213

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2-aminophenoxy)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide 2-(2-aminophenoxy)-N-(4,5,6,7-te…

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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)	2.53	6.17	-17.01	3	5	0	77	303.387	4	↓ MOL2 SDF SMILES Flexibase

49551267

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4-aminophenoxy)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide 2-(4-aminophenoxy)-N-(4,5,6,7-te…

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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)	2.17	6.08	-18.71	3	5	0	77	303.387	4	↓ MOL2 SDF SMILES Flexibase

49551274

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(3-aminophenoxy)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide 2-(3-aminophenoxy)-N-(4,5,6,7-te…

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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)	2.14	6.09	-18.87	3	5	0	77	303.387	4	↓ 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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