UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

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Popular Name: 2-(4,5-dimethyl-2-oxo-thiazol-3-yl)-N-[(3R)-1,1-dioxothiolan-3-yl]-N-methyl-acetamide 2-(4,5-dimethyl-2-oxo-thiazol-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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -0.30 2.8 -26.53 0 6 0 76 318.42 3 ↓

Analogs

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Popular Name: 2-(4,5-dimethyl-2-oxo-thiazol-3-yl)-N-[(3S)-1,1-dioxothiolan-3-yl]-N-methyl-acetamide 2-(4,5-dimethyl-2-oxo-thiazol-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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -0.30 2.82 -23.47 0 6 0 76 318.42 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4,5-dimethyl-2-oxo-thiazol-3-yl)-N-[(3R)-1,1-dioxothiolan-3-yl]acetamide 2-(4,5-dimethyl-2-oxo-thiazol-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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -0.55 1.1 -25.23 1 6 0 85 304.393 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(4,5-dimethyl-2-oxo-thiazol-3-yl)-N-[(3S)-1,1-dioxothiolan-3-yl]acetamide 2-(4,5-dimethyl-2-oxo-thiazol-3-…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) -0.55 1.11 -23.45 1 6 0 85 304.393 3 ↓

Parameters Provided:

ring.id = 540697
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 = 540697 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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