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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: 3-[3-(3-fluoro-4-methyl-phenyl)-1,2,4-oxadiazol-5-yl]thiophen-2-amine 3-[3-(3-fluoro-4-methyl-phenyl)-…

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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) 2.88 5.47 -13.38 1 4 0 63 275.308 2 ↓
Mid Mid (pH 6-8) 3.46 4.57 -9.54 2 4 0 65 275.308 2 ↓

Analogs

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Popular Name: 3-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-4,5-dimethyl-thiophen-2-amine 3-[3-(2-fluorophenyl)-1,2,4-oxad…

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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) 3.37 5.27 -14.62 1 4 0 63 289.335 2 ↓
Mid Mid (pH 6-8) 3.63 5.86 -12.82 2 4 0 65 289.335 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]thiophen-2-amine 3-[3-(2-fluorophenyl)-1,2,4-oxad…

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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) 2.46 4.9 -15.46 1 4 0 63 261.281 2 ↓
Mid Mid (pH 6-8) 3.04 3.96 -12.13 2 4 0 65 261.281 2 ↓

Analogs

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Popular Name: 3-[3-(3-chloro-4-fluoro-phenyl)-1,2,4-oxadiazol-5-yl]thiophen-2-amine 3-[3-(3-chloro-4-fluoro-phenyl)-…

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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) 3.11 5.32 -11.97 1 4 0 63 295.726 2 ↓
Mid Mid (pH 6-8) 3.69 4.37 -7.26 2 4 0 65 295.726 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[3-(3-fluoro-4-methyl-phenyl)-1,2,4-oxadiazol-5-yl]-4,5-dimethyl-thiophen-2-amine 3-[3-(3-fluoro-4-methyl-phenyl)-…

Find On: PubMed — Wikipedia — Google

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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) 3.79 5.86 -11.57 1 4 0 63 303.362 2 ↓

Parameters Provided:

ring.id = 61844
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 = 61844 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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