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ZINC Item

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54861503

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-7-one 2-[(2S,6R)-2,6-dimethylmorpholin…

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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)	3.14	7.09	-9.23	0	4	0	42	294.42	1	↓ MOL2 SDF SMILES Flexibase

54861505

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-7-one 2-[(2S,6S)-2,6-dimethylmorpholin…

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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)	3.14	7.19	-9.3	0	4	0	42	294.42	1	↓ MOL2 SDF SMILES Flexibase

54861507

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-7-one 2-[(2R,6R)-2,6-dimethylmorpholin…

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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)	3.14	7.2	-9.17	0	4	0	42	294.42	1	↓ MOL2 SDF SMILES Flexibase

54861509

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-5,6-dihydro-4H-1,3-benzothiazol-7-one 2-[(2S,6R)-2,6-dimethylmorpholin…

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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)	2.25	6.17	-9.93	0	4	0	42	266.366	1	↓ MOL2 SDF SMILES Flexibase

54861511

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-5,6-dihydro-4H-1,3-benzothiazol-7-one 2-[(2S,6S)-2,6-dimethylmorpholin…

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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)	2.25	6.27	-10.05	0	4	0	42	266.366	1	↓ MOL2 SDF SMILES Flexibase

54861513

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-5,6-dihydro-4H-1,3-benzothiazol-7-one 2-[(2R,6R)-2,6-dimethylmorpholin…

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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)	2.25	6.29	-9.96	0	4	0	42	266.366	1	↓ MOL2 SDF SMILES Flexibase

54861565

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5,5-dimethyl-2-[(2R)-2-methylmorpholin-4-yl]-4,6-dihydro-1,3-benzothiazol-7-one 5,5-dimethyl-2-[(2R)-2-methylmor…

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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)	2.77	6.33	-9.43	0	4	0	42	280.393	1	↓ MOL2 SDF SMILES Flexibase

54861568

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5,5-dimethyl-2-[(2S)-2-methylmorpholin-4-yl]-4,6-dihydro-1,3-benzothiazol-7-one 5,5-dimethyl-2-[(2S)-2-methylmor…

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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)	2.77	6.33	-9.46	0	4	0	42	280.393	1	↓ MOL2 SDF SMILES Flexibase

54861571

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2R)-2-methylmorpholin-4-yl]-5,6-dihydro-4H-1,3-benzothiazol-7-one 2-[(2R)-2-methylmorpholin-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)	1.89	5.42	-10.26	0	4	0	42	252.339	1	↓ MOL2 SDF SMILES Flexibase

54861574

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2S)-2-methylmorpholin-4-yl]-5,6-dihydro-4H-1,3-benzothiazol-7-one 2-[(2S)-2-methylmorpholin-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)	1.89	5.42	-10.2	0	4	0	42	252.339	1	↓ MOL2 SDF SMILES Flexibase

54862135

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2R,5R)-2,5-dimethylmorpholin-4-yl]-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-7-one 2-[(2R,5R)-2,5-dimethylmorpholin…

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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)	3.10	7.08	-9.36	0	4	0	42	294.42	1	↓ MOL2 SDF SMILES Flexibase

54862136

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2S,5R)-2,5-dimethylmorpholin-4-yl]-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-7-one 2-[(2S,5R)-2,5-dimethylmorpholin…

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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)	3.10	7.43	-9.14	0	4	0	42	294.42	1	↓ MOL2 SDF SMILES Flexibase

54862138

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2R,5R)-2,5-dimethylmorpholin-4-yl]-5,6-dihydro-4H-1,3-benzothiazol-7-one 2-[(2R,5R)-2,5-dimethylmorpholin…

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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)	2.22	6.16	-10.06	0	4	0	42	266.366	1	↓ MOL2 SDF SMILES Flexibase

54862141

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2S,5R)-2,5-dimethylmorpholin-4-yl]-5,6-dihydro-4H-1,3-benzothiazol-7-one 2-[(2S,5R)-2,5-dimethylmorpholin…

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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)	2.22	6.51	-9.87	0	4	0	42	266.366	1	↓ MOL2 SDF SMILES Flexibase

54862148

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5,5-dimethyl-2-[(3R)-3-methylmorpholin-4-yl]-4,6-dihydro-1,3-benzothiazol-7-one 5,5-dimethyl-2-[(3R)-3-methylmor…

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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)	2.74	6.75	-9.5	0	4	0	42	280.393	1	↓ MOL2 SDF SMILES Flexibase

54862150

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5,5-dimethyl-2-[(3S)-3-methylmorpholin-4-yl]-4,6-dihydro-1,3-benzothiazol-7-one 5,5-dimethyl-2-[(3S)-3-methylmor…

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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)	2.74	6.68	-9.5	0	4	0	42	280.393	1	↓ MOL2 SDF SMILES Flexibase

54862151

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(3R)-3-methylmorpholin-4-yl]-5,6-dihydro-4H-1,3-benzothiazol-7-one 2-[(3R)-3-methylmorpholin-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)	1.85	5.83	-10.25	0	4	0	42	252.339	1	↓ MOL2 SDF SMILES Flexibase

54862153

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(3S)-3-methylmorpholin-4-yl]-5,6-dihydro-4H-1,3-benzothiazol-7-one 2-[(3S)-3-methylmorpholin-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)	1.85	5.76	-10.27	0	4	0	42	252.339	1	↓ MOL2 SDF SMILES Flexibase

54862170

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2R)-2-ethylmorpholin-4-yl]-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-7-one 2-[(2R)-2-ethylmorpholin-4-yl]-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)	3.28	7.17	-9.37	0	4	0	42	294.42	2	↓ MOL2 SDF SMILES Flexibase

54862173

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2S)-2-ethylmorpholin-4-yl]-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-7-one 2-[(2S)-2-ethylmorpholin-4-yl]-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)	3.28	7.17	-9.4	0	4	0	42	294.42	2	↓ MOL2 SDF SMILES Flexibase

54862174

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2R)-2-ethylmorpholin-4-yl]-5,6-dihydro-4H-1,3-benzothiazol-7-one 2-[(2R)-2-ethylmorpholin-4-yl]-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)	2.39	6.25	-10.11	0	4	0	42	266.366	2	↓ MOL2 SDF SMILES Flexibase

54862176

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2S)-2-ethylmorpholin-4-yl]-5,6-dihydro-4H-1,3-benzothiazol-7-one 2-[(2S)-2-ethylmorpholin-4-yl]-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)	2.39	6.25	-10.08	0	4	0	42	266.366	2	↓ MOL2 SDF SMILES Flexibase

54862355

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2,2-dimethylmorpholin-4-yl)-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-7-one 2-(2,2-dimethylmorpholin-4-yl)-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)	3.22	7.1	-9.24	0	4	0	42	294.42	1	↓ MOL2 SDF SMILES Flexibase

54862357

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(2,2-dimethylmorpholin-4-yl)-5,6-dihydro-4H-1,3-benzothiazol-7-one 2-(2,2-dimethylmorpholin-4-yl)-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)	2.33	6.17	-10.02	0	4	0	42	266.366	1	↓ MOL2 SDF SMILES Flexibase

54862377

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(3R)-3-ethylmorpholin-4-yl]-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-7-one 2-[(3R)-3-ethylmorpholin-4-yl]-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)	3.28	6.08	-9.86	0	4	0	42	294.42	2	↓ MOL2 SDF SMILES Flexibase

54862379

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(3S)-3-ethylmorpholin-4-yl]-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-7-one 2-[(3S)-3-ethylmorpholin-4-yl]-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)	3.28	6.1	-9.89	0	4	0	42	294.42	2	↓ MOL2 SDF SMILES Flexibase

54862381

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(3R)-3-ethylmorpholin-4-yl]-5,6-dihydro-4H-1,3-benzothiazol-7-one 2-[(3R)-3-ethylmorpholin-4-yl]-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)	2.39	5.17	-10.61	0	4	0	42	266.366	2	↓ MOL2 SDF SMILES Flexibase

54862383

Analogs

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Popular Name: 2-[(3S)-3-ethylmorpholin-4-yl]-5,6-dihydro-4H-1,3-benzothiazol-7-one 2-[(3S)-3-ethylmorpholin-4-yl]-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)	2.39	5.18	-10.55	0	4	0	42	266.366	2	↓ MOL2 SDF SMILES Flexibase

54863231

Analogs

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Popular Name: 5,5-dimethyl-2-[(6R)-2,2,6-trimethylmorpholin-4-yl]-4,6-dihydro-1,3-benzothiazol-7-one 5,5-dimethyl-2-[(6R)-2,2,6-trime…

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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)	3.58	7.82	-9.06	0	4	0	42	308.447	1	↓ MOL2 SDF SMILES Flexibase

54863233

Analogs

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Popular Name: 5,5-dimethyl-2-[(6S)-2,2,6-trimethylmorpholin-4-yl]-4,6-dihydro-1,3-benzothiazol-7-one 5,5-dimethyl-2-[(6S)-2,2,6-trime…

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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)	3.58	7.82	-9.02	0	4	0	42	308.447	1	↓ MOL2 SDF SMILES Flexibase

54863235

Analogs

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Popular Name: 2-[(6R)-2,2,6-trimethylmorpholin-4-yl]-5,6-dihydro-4H-1,3-benzothiazol-7-one 2-[(6R)-2,2,6-trimethylmorpholin…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.69	6.9	-9.75	0	4	0	42	280.393	1	↓ MOL2 SDF SMILES Flexibase

54863237

Analogs

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Popular Name: 2-[(6S)-2,2,6-trimethylmorpholin-4-yl]-5,6-dihydro-4H-1,3-benzothiazol-7-one 2-[(6S)-2,2,6-trimethylmorpholin…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.69	6.9	-9.75	0	4	0	42	280.393	1	↓ MOL2 SDF SMILES Flexibase

54863495

Analogs

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Popular Name: 2-[(2R,5R)-5-ethyl-2-methyl-morpholin-4-yl]-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-7-one 2-[(2R,5R)-5-ethyl-2-methyl-morp…

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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)	3.64	7.97	-9.35	0	4	0	42	308.447	2	↓ MOL2 SDF SMILES Flexibase

54863496

Analogs

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Popular Name: 2-[(2R,5S)-5-ethyl-2-methyl-morpholin-4-yl]-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-7-one 2-[(2R,5S)-5-ethyl-2-methyl-morp…

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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)	3.64	6.84	-9.55	0	4	0	42	308.447	2	↓ MOL2 SDF SMILES Flexibase

54863498

Analogs

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Popular Name: 2-[(2S,5R)-5-ethyl-2-methyl-morpholin-4-yl]-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-7-one 2-[(2S,5R)-5-ethyl-2-methyl-morp…

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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)	3.64	6.83	-9.54	0	4	0	42	308.447	2	↓ MOL2 SDF SMILES Flexibase

54863500

Analogs

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Popular Name: 2-[(2S,5S)-5-ethyl-2-methyl-morpholin-4-yl]-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-7-one 2-[(2S,5S)-5-ethyl-2-methyl-morp…

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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)	3.64	7.97	-9.32	0	4	0	42	308.447	2	↓ MOL2 SDF SMILES Flexibase

54863502

Analogs

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Popular Name: 2-[(2R,5R)-5-ethyl-2-methyl-morpholin-4-yl]-5,6-dihydro-4H-1,3-benzothiazol-7-one 2-[(2R,5R)-5-ethyl-2-methyl-morp…

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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	7.05	-10.03	0	4	0	42	280.393	2	↓ MOL2 SDF SMILES Flexibase

54863503

Analogs

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Popular Name: 2-[(2R,5S)-5-ethyl-2-methyl-morpholin-4-yl]-5,6-dihydro-4H-1,3-benzothiazol-7-one 2-[(2R,5S)-5-ethyl-2-methyl-morp…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.75	5.93	-10.27	0	4	0	42	280.393	2	↓ MOL2 SDF SMILES Flexibase

54863506

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2S,5R)-5-ethyl-2-methyl-morpholin-4-yl]-5,6-dihydro-4H-1,3-benzothiazol-7-one 2-[(2S,5R)-5-ethyl-2-methyl-morp…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.75	5.91	-10.25	0	4	0	42	280.393	2	↓ MOL2 SDF SMILES Flexibase

54863508

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(2S,5S)-5-ethyl-2-methyl-morpholin-4-yl]-5,6-dihydro-4H-1,3-benzothiazol-7-one 2-[(2S,5S)-5-ethyl-2-methyl-morp…

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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	7.05	-10.05	0	4	0	42	280.393	2	↓ MOL2 SDF SMILES Flexibase

54863636

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(3,3-dimethylmorpholin-4-yl)-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-7-one 2-(3,3-dimethylmorpholin-4-yl)-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)	3.22	7.39	-9.37	0	4	0	42	294.42	1	↓ MOL2 SDF SMILES Flexibase

54863639

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(3,3-dimethylmorpholin-4-yl)-5,6-dihydro-4H-1,3-benzothiazol-7-one 2-(3,3-dimethylmorpholin-4-yl)-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)	2.33	6.4	-10.08	0	4	0	42	266.366	1	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

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

SQL Query Was

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<script type="text/javascript" src="//zinc12.docking.org/js/embed.js"></script>
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