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

13122466
13122466

Draw Identity 99% 90% 80% 70%

Popular Name: 5-[(Z)-styryl]-1,3,4-oxadiazole-2-thiol 5-[(Z)-styryl]-1,3,4-oxadiazole-…

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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) 2.34 2.93 -43.73 0 3 -1 39 203.246 2 ↓
Mid Mid (pH 6-8) 1.61 3.47 -9.86 1 3 0 42 204.254 2 ↓

Analogs

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Popular Name: 1,3,4-oxadiazole, 2-(chloromethyl)-5-[(E)-2-(2-chlorophenyl)ethenyl]- 1,3,4-oxadiazole, 2-(chloromethy…

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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) 2.40 3.46 -9.46 0 3 0 39 255.104 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1,3,4-oxadiazole, 2-(chloromethyl)-5-[(E)-2-(2-methoxyphenyl)ethenyl]- 1,3,4-oxadiazole, 2-(chloromethy…

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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) 1.78 2.39 -10.18 0 4 0 48 250.685 4 ↓

Analogs

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Popular Name: 1,3,4-oxadiazole, 2-(chloromethyl)-5-[(E)-2-phenylethenyl]- 1,3,4-oxadiazole, 2-(chloromethy…

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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) 1.95 3.03 -7.95 0 3 0 39 220.659 3 ↓

Analogs

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Popular Name: 1,3,4-oxadiazole, 2-(chloromethyl)-5-[(E)-2-(4-methoxyphenyl)ethenyl]- 1,3,4-oxadiazole, 2-(chloromethy…

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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) 2.00 2.33 -9.15 0 4 0 48 250.685 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1,3,4-oxadiazole, 2-(chloromethyl)-5-[(E)-2-(4-fluorophenyl)ethenyl]- 1,3,4-oxadiazole, 2-(chloromethy…

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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) 2.11 3.09 -8.6 0 3 0 39 238.649 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1,3,4-oxadiazole, 2-(chloromethyl)-5-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]- 1,3,4-oxadiazole, 2-(chloromethy…

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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) 1.60 2.24 -11.71 0 5 0 57 280.711 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1,3,4-oxadiazole, 2-(chloromethyl)-5-[(E)-2-(4-methylphenyl)ethenyl]- 1,3,4-oxadiazole, 2-(chloromethy…

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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) 2.40 3.71 -7.85 0 3 0 39 234.686 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1,3,4-oxadiazole, 2-(chloromethyl)-5-[(E)-2-(3-nitrophenyl)ethenyl]- 1,3,4-oxadiazole, 2-(chloromethy…

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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) 1.88 3.74 -13.93 0 6 0 85 265.656 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1,3,4-oxadiazole, 2-(chloromethyl)-5-[(E)-2-(4-nitrophenyl)ethenyl]- 1,3,4-oxadiazole, 2-(chloromethy…

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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) 1.91 3.75 -12.44 0 6 0 85 265.656 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1,3,4-oxadiazole, 2-(chloromethyl)-5-[(E)-2-(4-chlorophenyl)ethenyl]- 1,3,4-oxadiazole, 2-(chloromethy…

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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) 2.63 3.55 -8.1 0 3 0 39 255.104 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1,3,4-oxadiazole, 2-(chloromethyl)-5-[(E)-2-(4-ethoxyphenyl)ethenyl]- 1,3,4-oxadiazole, 2-(chloromethy…

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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) 2.38 3.26 -8.94 0 4 0 48 264.712 5 ↓

Parameters Provided:

ring.id = 158709
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 = 158709 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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