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

11842306
11842306

Draw Identity 99% 90% 80% 70%

Popular Name: (3R)-N,N-diethyl-1-[[3-(2-pyridyl)-1,2,4-oxadiazol-5-yl]methyl]piperidine-3-carboxamide (3R)-N,N-diethyl-1-[[3-(2-pyridy…

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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) 1.58 -0.7 -45.4 1 7 1 77 344.439 6 ↓

Analogs

11842305
11842305

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Popular Name: (3S)-N,N-diethyl-1-[[3-(2-pyridyl)-1,2,4-oxadiazol-5-yl]methyl]piperidine-3-carboxamide (3S)-N,N-diethyl-1-[[3-(2-pyridy…

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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) 1.58 -0.38 -45.77 1 7 1 77 344.439 6 ↓

Analogs

39357805
39357805
44513474
44513474
12442579
12442579
20908109
20908109

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperidin-4-amine 1-[(3-pyridin-2-yl-1,2,4-oxadiaz…

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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) -0.03 2.17 -42.69 3 6 1 82 260.321 3 ↓
Lo Low (pH 4.5-6) -0.03 2.5 -114.39 4 6 2 84 261.329 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[1-[[3-(2-pyridyl)-1,2,4-oxadiazol-5-yl]methyl]-4-piperidyl]ethanamine 2-[1-[[3-(2-pyridyl)-1,2,4-oxadi…

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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) 0.74 3.57 -103.05 4 6 2 84 289.383 5 ↓
Lo Low (pH 4.5-6) 0.74 4.12 -157.88 5 6 3 85 290.391 5 ↓

Parameters Provided:

ring.id = 59835
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 = 59835 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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