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

Analogs

7149678
7149678

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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) 0.75 3.22 -11.12 0 6 0 89 306.343 5 ↓

Analogs

7149674
7149674

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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) 0.75 3.22 -10.99 0 6 0 89 306.343 5 ↓

Analogs

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Popular Name: (3R)-3-[(3-amino-2-pyridyl)sulfanyl]tetrahydrofuran-2-one (3R)-3-[(3-amino-2-pyridyl)sulfa…

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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) -0.10 3.5 -11.9 2 4 0 65 210.258 2 ↓

Analogs

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Popular Name: (3S)-3-[(3-amino-2-pyridyl)sulfanyl]tetrahydrofuran-2-one (3S)-3-[(3-amino-2-pyridyl)sulfa…

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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) -0.10 3.49 -11.9 2 4 0 65 210.258 2 ↓

Analogs

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Popular Name: (3R)-3-[(5-amino-2-pyridyl)sulfanyl]tetrahydrofuran-2-one (3R)-3-[(5-amino-2-pyridyl)sulfa…

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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) 0.12 3.43 -11.69 2 4 0 65 210.258 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-3-[(5-amino-2-pyridyl)sulfanyl]tetrahydrofuran-2-one (3S)-3-[(5-amino-2-pyridyl)sulfa…

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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) 0.12 3.44 -11.67 2 4 0 65 210.258 2 ↓

Analogs

1400337
1400337
1400338
1400338

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Popular Name: 6-[(3R)-2-oxotetrahydrofuran-3-yl]sulfanylpyridine-3-carboxylic 6-[(3R)-2-oxotetrahydrofuran-3-y…

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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) 0.05 6.09 -54.29 0 5 -1 79 238.244 3 ↓

Analogs

1400337
1400337
1400338
1400338

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Popular Name: 6-[(3S)-2-oxotetrahydrofuran-3-yl]sulfanylpyridine-3-carboxylic 6-[(3S)-2-oxotetrahydrofuran-3-y…

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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) 0.05 6.09 -54.29 0 5 -1 79 238.244 3 ↓

Analogs

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Popular Name: (3S,5R)-5-methyl-3-[(3-nitro-2-pyridyl)sulfanyl]tetrahydrofuran-2-one (3S,5R)-5-methyl-3-[(3-nitro-2-p…

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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) 0.49 6.86 -13.19 0 6 0 85 254.267 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S,5S)-5-methyl-3-[(3-nitro-2-pyridyl)sulfanyl]tetrahydrofuran-2-one (3S,5S)-5-methyl-3-[(3-nitro-2-p…

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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) 0.49 6.78 -13.37 0 6 0 85 254.267 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R,5R)-5-methyl-3-[(3-nitro-2-pyridyl)sulfanyl]tetrahydrofuran-2-one (3R,5R)-5-methyl-3-[(3-nitro-2-p…

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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) 0.49 6.84 -12.51 0 6 0 85 254.267 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R,5S)-5-methyl-3-[(3-nitro-2-pyridyl)sulfanyl]tetrahydrofuran-2-one (3R,5S)-5-methyl-3-[(3-nitro-2-p…

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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) 0.49 6.86 -13.22 0 6 0 85 254.267 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-3-[(3-nitro-2-pyridyl)sulfanyl]tetrahydrofuran-2-one (3R)-3-[(3-nitro-2-pyridyl)sulfa…

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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) 0.38 6.12 -13.49 0 6 0 85 240.24 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-3-[(3-nitro-2-pyridyl)sulfanyl]tetrahydrofuran-2-one (3S)-3-[(3-nitro-2-pyridyl)sulfa…

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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) 0.38 6.12 -13.48 0 6 0 85 240.24 3 ↓

Parameters Provided:

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filter.purchasability = annotated
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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 = 4942 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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