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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: 2-[(5-benzo[1,3]dioxol-5-yl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-(1-cyano-1-methyl-ethyl)-N-methyl-aceta 2-[(5-benzo[1,3]dioxol-5-yl-1,3,…

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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) 2.36 -1.26 -11.12 0 8 0 101 360.395 5 ↓

Analogs

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

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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) 2.82 1.92 -8.72 0 5 0 57 311.135 3 ↓

Analogs

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

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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) 2.82 1.92 -8.73 0 5 0 57 311.135 3 ↓

Analogs

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Popular Name: (1S)-1-[5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]propan-1-amine (1S)-1-[5-(1,3-benzodioxol-5-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) -0.38 -1.31 -48.54 3 6 1 85 248.262 3 ↓
Hi High (pH 8-9.5) -0.38 -1.68 -9.05 2 6 0 83 247.254 3 ↓

Analogs

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Popular Name: (1R)-1-[5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]propan-1-amine (1R)-1-[5-(1,3-benzodioxol-5-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) -0.38 -1.32 -48.47 3 6 1 85 248.262 3 ↓
Hi High (pH 8-9.5) -0.38 -1.65 -7.93 2 6 0 83 247.254 3 ↓

Analogs

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Popular Name: (1S)-1-[5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]-N-methyl-propan-1-amine (1S)-1-[5-(1,3-benzodioxol-5-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) 1.87 0.43 -43.58 2 6 1 74 262.289 4 ↓
Hi High (pH 8-9.5) 1.87 -0.6 -7.81 1 6 0 69 261.281 4 ↓

Analogs

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Popular Name: (1R)-1-[5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]-N-methyl-propan-1-amine (1R)-1-[5-(1,3-benzodioxol-5-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) 1.87 0.44 -43.54 2 6 1 74 262.289 4 ↓
Hi High (pH 8-9.5) 1.87 -0.91 -9.91 1 6 0 69 261.281 4 ↓

Analogs

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Popular Name: (2S)-2-[[5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]thio]propionamide (2S)-2-[[5-(1,3-benzodioxol-5-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) 1.51 -5.15 -11.69 2 7 0 100 293.304 4 ↓

Analogs

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Popular Name: (2R)-2-[[5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]thio]propionamide (2R)-2-[[5-(1,3-benzodioxol-5-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) 1.51 -5.16 -11.6 2 7 0 100 293.304 4 ↓

Analogs

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Popular Name: 2-(1,3-benzodioxol-5-yl)-5-(methylthio)-1,3,4-oxadiazole 2-(1,3-benzodioxol-5-yl)-5-(meth…

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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) 2.42 -2.52 -8.54 0 5 0 57 236.252 2 ↓

Analogs

6561678
6561678

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Popular Name: 4-[(5-benzo[1,3]dioxol-5-yl-1,3,4-oxadiazol-2-yl)sulfanyl]butanenitrile 4-[(5-benzo[1,3]dioxol-5-yl-1,3,…

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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) 2.15 -1.22 -14.07 0 6 0 81 289.316 5 ↓

Analogs

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Popular Name: 2-[(5-benzo[1,3]dioxol-5-yl-1,3,4-oxadiazol-2-yl)sulfanyl]ethyl 2-[(5-benzo[1,3]dioxol-5-yl-1,3,…

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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) 1.90 -6.19 -12.41 2 8 0 109 309.303 6 ↓

Analogs

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Popular Name: 5-[5-(1,3-benzodioxol-5-yl)-1,3,4-oxadiazol-2-yl]pentanoic 5-[5-(1,3-benzodioxol-5-yl)-1,3,…

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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) 1.72 2.82 -48.9 0 7 -1 98 289.267 6 ↓

Parameters Provided:

ring.id = 5322
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 = 5322 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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