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

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Popular Name: (3aR,6aR)-N-benzyl-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d]thiazol-2-amine (3aR,6aR)-N-benzyl-5,5-dioxo-3a,…

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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) 1.03 3.43 -44.07 2 4 1 60 283.398 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3aS,6aR)-N-benzyl-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d]thiazol-2-amine (3aS,6aR)-N-benzyl-5,5-dioxo-3a,…

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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) 1.03 3.13 -42.02 2 4 1 60 283.398 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3aR,6aS)-N-benzyl-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d]thiazol-2-amine (3aR,6aS)-N-benzyl-5,5-dioxo-3a,…

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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) 1.03 3.14 -41.84 2 4 1 60 283.398 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3aR,6aR)-N-allyl-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d]thiazol-2-amine (3aR,6aR)-N-allyl-5,5-dioxo-3a,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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.28 0.99 -42.19 2 4 1 60 233.338 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3aS,6aR)-N-allyl-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d]thiazol-2-amine (3aS,6aR)-N-allyl-5,5-dioxo-3a,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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.28 0.68 -39.85 2 4 1 60 233.338 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3aR,6aS)-N-allyl-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d]thiazol-2-amine (3aR,6aS)-N-allyl-5,5-dioxo-3a,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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.28 0.7 -39.63 2 4 1 60 233.338 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3aS,6aS)-N-allyl-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d]thiazol-2-amine (3aS,6aS)-N-allyl-5,5-dioxo-3a,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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.28 0.82 -41.98 2 4 1 60 233.338 3 ↓

Parameters Provided:

ring.id = 503060
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 = 503060 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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