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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[(8aS)-5,8-dioxo-1,3,6,8a-tetrahydrothiazolo[4,3-c]pyrazin-7-yl]methyl]-N-isopropyl-benzamide 4-[[(8aS)-5,8-dioxo-1,3,6,8a-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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.50 5.59 -19.69 1 6 0 70 347.44 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[(8aR)-5,8-dioxo-1,3,6,8a-tetrahydrothiazolo[4,3-c]pyrazin-7-yl]methyl]-N-isopropyl-benzamide 4-[[(8aR)-5,8-dioxo-1,3,6,8a-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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.50 5.63 -15.68 1 6 0 70 347.44 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[(8aS)-5,8-dioxo-1,3,6,8a-tetrahydrothiazolo[4,3-c]pyrazin-7-yl]methyl]-N-propyl-benzamide 4-[[(8aS)-5,8-dioxo-1,3,6,8a-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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.71 5.53 -19.56 1 6 0 70 347.44 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[(8aR)-5,8-dioxo-1,3,6,8a-tetrahydrothiazolo[4,3-c]pyrazin-7-yl]methyl]-N-propyl-benzamide 4-[[(8aR)-5,8-dioxo-1,3,6,8a-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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.71 5.57 -15.65 1 6 0 70 347.44 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[(8aS)-5,8-dioxo-1,3,6,8a-tetrahydrothiazolo[4,3-c]pyrazin-7-yl]methyl]-N-(2-diethylaminoethyl)be 4-[[(8aS)-5,8-dioxo-1,3,6,8a-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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.61 7.61 -52.03 2 7 1 74 405.544 8 ↓
Hi High (pH 8-9.5) 0.61 5.4 -19.92 1 7 0 73 404.536 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[(8aR)-5,8-dioxo-1,3,6,8a-tetrahydrothiazolo[4,3-c]pyrazin-7-yl]methyl]-N-(2-diethylaminoethyl)be 4-[[(8aR)-5,8-dioxo-1,3,6,8a-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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.61 7.65 -48.99 2 7 1 74 405.544 8 ↓
Hi High (pH 8-9.5) 0.61 5.44 -15.88 1 7 0 73 404.536 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[(8aS)-5,8-dioxo-1,3,6,8a-tetrahydrothiazolo[4,3-c]pyrazin-7-yl]methyl]-N-isopentyl-benzamide 4-[[(8aS)-5,8-dioxo-1,3,6,8a-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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.48 6.82 -19.35 1 6 0 70 375.494 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[(8aR)-5,8-dioxo-1,3,6,8a-tetrahydrothiazolo[4,3-c]pyrazin-7-yl]methyl]-N-isopentyl-benzamide 4-[[(8aR)-5,8-dioxo-1,3,6,8a-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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.48 6.86 -15.49 1 6 0 70 375.494 6 ↓

Analogs

6669045
6669045
6669046
6669046

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[(8aS)-5,8-dioxo-1,3,6,8a-tetrahydrothiazolo[4,3-c]pyrazin-7-yl]methyl]-N-(2-methoxyethyl)benzami 4-[[(8aS)-5,8-dioxo-1,3,6,8a-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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -0.19 3.83 -19.72 1 7 0 79 363.439 6 ↓

Analogs

6669045
6669045
6669046
6669046

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[(8aR)-5,8-dioxo-1,3,6,8a-tetrahydrothiazolo[4,3-c]pyrazin-7-yl]methyl]-N-(2-methoxyethyl)benzami 4-[[(8aR)-5,8-dioxo-1,3,6,8a-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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -0.19 3.87 -15.92 1 7 0 79 363.439 6 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[(8aS)-5,8-dioxo-1,3,6,8a-tetrahydrothiazolo[4,3-c]pyrazin-7-yl]methyl]-N-methyl-benzamide 4-[[(8aS)-5,8-dioxo-1,3,6,8a-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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -0.17 3.92 -20.26 1 6 0 70 319.386 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[(8aR)-5,8-dioxo-1,3,6,8a-tetrahydrothiazolo[4,3-c]pyrazin-7-yl]methyl]-N-methyl-benzamide 4-[[(8aR)-5,8-dioxo-1,3,6,8a-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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -0.17 3.96 -16.31 1 6 0 70 319.386 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[(8aS)-5,8-dioxo-1,3,6,8a-tetrahydrothiazolo[4,3-c]pyrazin-7-yl]methyl]-N-(3-propylsulfanylpropyl 4-[[(8aS)-5,8-dioxo-1,3,6,8a-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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.50 8.43 -19.22 1 6 0 70 421.588 9 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-[[(8aR)-5,8-dioxo-1,3,6,8a-tetrahydrothiazolo[4,3-c]pyrazin-7-yl]methyl]-N-(3-propylsulfanylpropyl 4-[[(8aR)-5,8-dioxo-1,3,6,8a-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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.50 8.47 -15.64 1 6 0 70 421.588 9 ↓

Parameters Provided:

ring.id = 85437
filter.purchasability = annotated
page.format = targets
page.num = 1

Structural Results Found: (before additional filtering)

SQL Query Was

SELECT DISTINCT(ci.sub_id_fk) AS sub_id FROM catalog_item AS ci INNER JOIN catalog AS c ON ci.cat_id_fk=c.cat_id INNER JOIN hasring AS hr ON ci.sub_id_fk=hr.sub_id_fk INNER JOIN rings AS r ON hr.rings_fk=r.rings_id  WHERE r.rings_id = 85437 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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