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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: (2S)-1-[2-[(3R)-1,1-dioxothiolan-3-yl]sulfanylacetyl]piperidine-2-carboxylic (2S)-1-[2-[(3R)-1,1-dioxothiolan…

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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) -1.61 5.4 -73.86 0 6 -1 95 320.412 4 ↓

Analogs

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Popular Name: (2R)-1-[2-[(3R)-1,1-dioxothiolan-3-yl]sulfanylacetyl]piperidine-2-carboxylic (2R)-1-[2-[(3R)-1,1-dioxothiolan…

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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) -1.61 5.46 -74.5 0 6 -1 95 320.412 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-1-[2-[(3S)-1,1-dioxothiolan-3-yl]sulfanylacetyl]piperidine-2-carboxylic (2S)-1-[2-[(3S)-1,1-dioxothiolan…

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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) -1.61 5.39 -75.63 0 6 -1 95 320.412 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-1-[2-[(3S)-1,1-dioxothiolan-3-yl]sulfanylacetyl]piperidine-2-carboxylic (2R)-1-[2-[(3S)-1,1-dioxothiolan…

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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) -1.61 5.46 -76.03 0 6 -1 95 320.412 4 ↓

Analogs

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Popular Name: 2-[(3R)-1,1-dioxothiolan-3-yl]sulfanyl-1-(1-piperidyl)ethanone 2-[(3R)-1,1-dioxothiolan-3-yl]su…

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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) 0.62 3.8 -19.19 0 4 0 54 277.411 3 ↓

Analogs

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Popular Name: 1-[2-[(3R)-1,1-dioxothiolan-3-yl]sulfanylacetyl]-4-methyl-piperidine-4-carboxylic 1-[2-[(3R)-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) -0.03 4.6 -59.2 0 6 -1 95 334.439 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[2-[(3S)-1,1-dioxothiolan-3-yl]sulfanylacetyl]-4-methyl-piperidine-4-carboxylic 1-[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) -0.03 4.6 -59.84 0 6 -1 95 334.439 4 ↓

Analogs

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Popular Name: (3S)-1-[2-[(3R)-1,1-dioxothiolan-3-yl]sulfanylacetyl]-3-methyl-piperidine-3-carboxylic (3S)-1-[2-[(3R)-1,1-dioxothiolan…

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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) -0.03 5.03 -65.04 0 6 -1 95 334.439 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-1-[2-[(3R)-1,1-dioxothiolan-3-yl]sulfanylacetyl]-3-methyl-piperidine-3-carboxylic (3R)-1-[2-[(3R)-1,1-dioxothiolan…

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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) -0.03 5.05 -64.88 0 6 -1 95 334.439 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-1-[2-[(3S)-1,1-dioxothiolan-3-yl]sulfanylacetyl]-3-methyl-piperidine-3-carboxylic (3S)-1-[2-[(3S)-1,1-dioxothiolan…

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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) -0.03 5.04 -66.22 0 6 -1 95 334.439 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-1-[2-[(3S)-1,1-dioxothiolan-3-yl]sulfanylacetyl]-3-methyl-piperidine-3-carboxylic (3R)-1-[2-[(3S)-1,1-dioxothiolan…

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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) -0.03 5.05 -66.13 0 6 -1 95 334.439 4 ↓

Parameters Provided:

ring.id = 90348
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 = 90348 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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