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

33717082
33717082
33717083
33717083

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Popular Name: [(2S,3R,4R,5S,6S)-3,4,5-triacetoxy-6-[5-(chloromethyl)-1,3,4-oxadiazol-2-yl]tetrahydropyran-2-yl]met [(2S,3R,4R,5S,6S)-3,4,5-triaceto…

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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) -0.39 4.75 -22.71 0 12 0 153 448.812 11 ↓

Analogs

33414723
33414723

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Popular Name: [(2S,3R,4R,5S,6S)-4,5-diacetoxy-2-(acetoxymethyl)-6-[5-(azidomethyl)-1,3,4-oxadiazol-2-yl]tetrahydro [(2S,3R,4R,5S,6S)-4,5-diacetoxy-…

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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 0.8 -22.63 0 15 0 203 455.38 12 ↓

Analogs

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Popular Name: 2-[(1S)-1-bromopropyl]-5-[(2S)-tetrahydropyran-2-yl]-1,3,4-oxadiazole 2-[(1S)-1-bromopropyl]-5-[(2S)-t…

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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 1.28 -7.87 0 4 0 48 275.146 3 ↓

Analogs

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Popular Name: 2-[(1R)-1-bromopropyl]-5-[(2S)-tetrahydropyran-2-yl]-1,3,4-oxadiazole 2-[(1R)-1-bromopropyl]-5-[(2S)-t…

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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 1.27 -8.01 0 4 0 48 275.146 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(1S)-1-bromopropyl]-5-[(2R)-tetrahydropyran-2-yl]-1,3,4-oxadiazole 2-[(1S)-1-bromopropyl]-5-[(2R)-t…

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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 1.28 -8 0 4 0 48 275.146 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(1R)-1-bromopropyl]-5-[(2R)-tetrahydropyran-2-yl]-1,3,4-oxadiazole 2-[(1R)-1-bromopropyl]-5-[(2R)-t…

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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 1.27 -7.85 0 4 0 48 275.146 3 ↓

Analogs

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Popular Name: (1S)-1-[5-[(2S)-tetrahydropyran-2-yl]-1,3,4-oxadiazol-2-yl]propan-1-amine (1S)-1-[5-[(2S)-tetrahydropyran-…

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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) -1.79 -1.97 -45.69 3 5 1 76 212.273 3 ↓
Hi High (pH 8-9.5) -1.79 -2.32 -8.38 2 5 0 74 211.265 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-[5-[(2S)-tetrahydropyran-2-yl]-1,3,4-oxadiazol-2-yl]propan-1-amine (1R)-1-[5-[(2S)-tetrahydropyran-…

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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) -1.79 -1.98 -45.06 3 5 1 76 212.273 3 ↓
Hi High (pH 8-9.5) -1.79 -2.3 -7.15 2 5 0 74 211.265 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1S)-1-[5-[(2R)-tetrahydropyran-2-yl]-1,3,4-oxadiazol-2-yl]propan-1-amine (1S)-1-[5-[(2R)-tetrahydropyran-…

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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) -1.79 -1.97 -45.05 3 5 1 76 212.273 3 ↓
Hi High (pH 8-9.5) -1.79 -2.32 -8.48 2 5 0 74 211.265 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (1R)-1-[5-[(2R)-tetrahydropyran-2-yl]-1,3,4-oxadiazol-2-yl]propan-1-amine (1R)-1-[5-[(2R)-tetrahydropyran-…

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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) -1.79 -1.98 -45.69 3 5 1 76 212.273 3 ↓
Hi High (pH 8-9.5) -1.79 -2.3 -7.18 2 5 0 74 211.265 3 ↓

Parameters Provided:

ring.id = 94480
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 = 94480 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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