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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-(1-naphthyl)morpholin-2-yl]methanamine [(2R,3S)-4-ethyl-3-(1-naphthyl)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) 2.10 4.93 -40.54 3 3 1 40 271.384 3 ↓
Hi High (pH 8-9.5) 2.10 4.56 -4.04 2 3 0 38 270.376 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,3S)-4-ethyl-3-(1-naphthyl)morpholin-2-yl]methanamine [(2S,3S)-4-ethyl-3-(1-naphthyl)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) 2.10 4.49 -39.63 3 3 1 40 271.384 3 ↓
Hi High (pH 8-9.5) 2.10 4.01 -4.38 2 3 0 38 270.376 3 ↓

Analogs

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

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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) 3.08 6.81 -35.65 2 3 1 29 285.411 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

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

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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) 3.08 6.36 -34.78 2 3 1 29 285.411 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R,3S)-3-(1-naphthyl)-4-propyl-morpholin-2-yl]methanamine [(2R,3S)-3-(1-naphthyl)-4-propyl…

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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) 2.60 5.68 -40.72 3 3 1 40 285.411 4 ↓
Hi High (pH 8-9.5) 2.60 5.31 -3.91 2 3 0 38 284.403 4 ↓
Lo Low (pH 4.5-6) 2.60 7.16 -109.75 4 3 2 41 286.419 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,3S)-3-(1-naphthyl)-4-propyl-morpholin-2-yl]methanamine [(2S,3S)-3-(1-naphthyl)-4-propyl…

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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) 2.60 5.24 -39.64 3 3 1 40 285.411 4 ↓
Hi High (pH 8-9.5) 2.60 4.76 -4.16 2 3 0 38 284.403 4 ↓
Lo Low (pH 4.5-6) 2.60 7 -103.55 4 3 2 41 286.419 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2R,3S)-4-isopropyl-3-(1-naphthyl)morpholin-2-yl]methanamine [(2R,3S)-4-isopropyl-3-(1-naphth…

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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) 2.39 5.28 -40.57 3 3 1 40 285.411 3 ↓
Hi High (pH 8-9.5) 2.39 4.91 -3.88 2 3 0 38 284.403 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: [(2S,3S)-4-isopropyl-3-(1-naphthyl)morpholin-2-yl]methanamine [(2S,3S)-4-isopropyl-3-(1-naphth…

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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) 2.39 4.94 -39.23 3 3 1 40 285.411 3 ↓
Hi High (pH 8-9.5) 2.39 4.46 -4.13 2 3 0 38 284.403 3 ↓

Parameters Provided:

ring.id = 529881
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 = 529881 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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