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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

20678321
20678321
20678325
20678325

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Popular Name: 2-[[(3S)-1,1-dioxothiolan-3-yl]-methyl-amino]-N-methyl-N-(p-tolylmethyl)acetamide 2-[[(3S)-1,1-dioxothiolan-3-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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.06 6.3 -56.94 1 5 1 59 325.454 5 ↓
Mid Mid (pH 6-8) 1.06 3.88 -19.56 0 5 0 58 324.446 5 ↓

Analogs

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Popular Name: 2-[[(3S,4S)-4-hydroxy-1,1-dioxo-thiolan-3-yl]-methyl-amino]-N-[(2-methoxyphenyl)methyl]acetamide 2-[[(3S,4S)-4-hydroxy-1,1-dioxo-…

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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) -0.04 -0.37 -54.87 3 7 1 97 343.425 6 ↓
Hi High (pH 8-9.5) -0.04 -2.31 -52.63 1 7 -1 99 341.409 6 ↓
Hi High (pH 8-9.5) -0.04 -2.83 -19.78 2 7 0 96 342.417 6 ↓

Analogs

55635620
55635620

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Popular Name: ethyl ethyl

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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) 1.42 5.08 -62.92 2 7 1 94 369.463 8 ↓
Mid Mid (pH 6-8) 1.42 2.66 -21.14 1 7 0 93 368.455 8 ↓

Analogs

55635619
55635619

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Popular Name: ethyl ethyl

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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) 1.42 5.12 -65.18 2 7 1 94 369.463 8 ↓
Mid Mid (pH 6-8) 1.42 2.93 -21.5 1 7 0 93 368.455 8 ↓

Parameters Provided:

ring.id = 28626
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 = 28626 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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