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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: [(2R,3S)-4-ethyl-3-(6-quinolyl)morpholin-2-yl]methanamine [(2R,3S)-4-ethyl-3-(6-quinolyl)m…

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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) 0.92 3.02 -44.48 3 4 1 53 272.372 3 ↓
Hi High (pH 8-9.5) 0.92 2.55 -6.12 2 4 0 51 271.364 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,3S)-4-ethyl-3-(6-quinolyl)morpholin-2-yl]methanamine [(2S,3S)-4-ethyl-3-(6-quinolyl)m…

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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) 0.92 3.02 -45.34 3 4 1 53 272.372 3 ↓
Hi High (pH 8-9.5) 0.92 2.64 -6.3 2 4 0 51 271.364 3 ↓

Analogs

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Popular Name: 1-[(2R,3S)-4-ethyl-3-(6-quinolyl)morpholin-2-yl]-N-methyl-methanamine 1-[(2R,3S)-4-ethyl-3-(6-quinolyl…

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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 4.9 -39.57 2 4 1 42 286.399 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(2S,3S)-4-ethyl-3-(6-quinolyl)morpholin-2-yl]-N-methyl-methanamine 1-[(2S,3S)-4-ethyl-3-(6-quinolyl…

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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 4.9 -40.33 2 4 1 42 286.399 4 ↓

Analogs

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Popular Name: [(2R,3S)-4-propyl-3-(6-quinolyl)morpholin-2-yl]methanamine [(2R,3S)-4-propyl-3-(6-quinolyl)…

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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) 1.42 3.77 -44.7 3 4 1 53 286.399 4 ↓
Hi High (pH 8-9.5) 1.42 3.4 -5.9 2 4 0 51 285.391 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,3S)-4-propyl-3-(6-quinolyl)morpholin-2-yl]methanamine [(2S,3S)-4-propyl-3-(6-quinolyl)…

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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) 1.42 3.77 -45.38 3 4 1 53 286.399 4 ↓
Hi High (pH 8-9.5) 1.42 3.31 -6.42 2 4 0 51 285.391 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R,3S)-4-isopropyl-3-(6-quinolyl)morpholin-2-yl]methanamine [(2R,3S)-4-isopropyl-3-(6-quinol…

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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) 1.22 3.46 -44.23 3 4 1 53 286.399 3 ↓
Hi High (pH 8-9.5) 1.22 3 -5.93 2 4 0 51 285.391 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,3S)-4-isopropyl-3-(6-quinolyl)morpholin-2-yl]methanamine [(2S,3S)-4-isopropyl-3-(6-quinol…

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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) 1.22 3.29 -44.72 3 4 1 53 286.399 3 ↓
Hi High (pH 8-9.5) 1.22 2.91 -6.18 2 4 0 51 285.391 3 ↓

Parameters Provided:

ring.id = 529855
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 = 529855 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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