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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
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ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

45654218
45654218
45654220
45654220

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2,3-dihydrobenzofuran-5-yl)-1-methyl-piperidin-4-amine N-(2,3-dihydrobenzofuran-5-yl)-1…

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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) 2.91 6.36 -40.01 2 3 1 26 233.335 2 ↓

Analogs

45654218
45654218
45654220
45654220

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Popular Name: N-(2,3-dihydrobenzofuran-5-yl)-1-isopropyl-piperidin-4-amine N-(2,3-dihydrobenzofuran-5-yl)-1…

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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) 3.58 7.55 -37.57 2 3 1 26 261.389 3 ↓

Analogs

45654218
45654218
45654220
45654220

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2,3-dihydrobenzofuran-5-yl)-1-ethyl-piperidin-4-amine N-(2,3-dihydrobenzofuran-5-yl)-1…

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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) 3.28 7.03 -38.9 2 3 1 26 247.362 3 ↓

Analogs

45654218
45654218
45654220
45654220

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2,3-dihydrobenzofuran-5-yl)-1-propyl-piperidin-4-amine N-(2,3-dihydrobenzofuran-5-yl)-1…

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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 7.77 -39.68 2 3 1 26 261.389 4 ↓

Analogs

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Popular Name: (2R,4S,5R)-N-(2,3-dihydrobenzofuran-5-yl)-1,2,5-trimethyl-piperidin-4-amine (2R,4S,5R)-N-(2,3-dihydrobenzofu…

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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) 3.71 7.55 -38.1 2 3 1 26 261.389 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,4S,5R)-N-(2,3-dihydrobenzofuran-5-yl)-1,2,5-trimethyl-piperidin-4-amine (2S,4S,5R)-N-(2,3-dihydrobenzofu…

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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) 3.71 7.89 -38.84 2 3 1 26 261.389 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R,4R,5R)-N-(2,3-dihydrobenzofuran-5-yl)-1,2,5-trimethyl-piperidin-4-amine (2R,4R,5R)-N-(2,3-dihydrobenzofu…

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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) 3.71 7.25 -38.97 2 3 1 26 261.389 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,4R,5R)-N-(2,3-dihydrobenzofuran-5-yl)-1,2,5-trimethyl-piperidin-4-amine (2S,4R,5R)-N-(2,3-dihydrobenzofu…

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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) 3.71 7.57 -38.75 2 3 1 26 261.389 2 ↓

Analogs

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Popular Name: ethyl ethyl

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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) 3.36 6.11 -9.85 1 5 0 51 290.363 4 ↓

Analogs

45654218
45654218
45654220
45654220

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[4-(2,3-dihydrobenzofuran-5-ylamino)-1-piperidyl]ethanone 1-[4-(2,3-dihydrobenzofuran-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) 2.27 5.35 -12.11 1 4 0 42 260.337 2 ↓

Analogs

45654218
45654218
45654220
45654220

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2,3-dihydrobenzofuran-5-yl)-1-prop-2-ynyl-piperidin-4-amine N-(2,3-dihydrobenzofuran-5-yl)-1…

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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) 3.07 7.57 -40.98 2 3 1 26 257.357 3 ↓
Mid Mid (pH 6-8) 3.07 5.29 -5.77 1 3 0 24 256.349 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2,3-dihydrobenzofuran-5-yl)-1-(3-methylbut-2-enyl)piperidin-4-amine N-(2,3-dihydrobenzofuran-5-yl)-1…

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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) 4.58 9.02 -39.58 2 3 1 26 287.427 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-(2,3-dihydrobenzofuran-5-ylamino)piperidine-1-carboxamide 4-(2,3-dihydrobenzofuran-5-ylami…

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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) 2.18 2.78 -12.48 3 5 0 68 261.325 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-(2,3-dihydrobenzofuran-5-yl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine N-(2,3-dihydrobenzofuran-5-yl)-1…

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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) 3.83 5.32 -6.75 1 3 0 24 300.324 4 ↓
Mid Mid (pH 6-8) 3.83 7.42 -46.05 2 3 1 26 301.332 4 ↓

Parameters Provided:

ring.id = 148821
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 = 148821 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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