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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: (3R)-3-[(1S)-1-aminoindan-4-yl]oxytetrahydrofuran-2-one (3R)-3-[(1S)-1-aminoindan-4-yl]o…

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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) -1.47 4.25 -52.46 3 4 1 63 234.275 2 ↓
Hi High (pH 8-9.5) -1.47 3.94 -9.98 2 4 0 62 233.267 2 ↓

Analogs

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Popular Name: (3S)-3-[(1S)-1-aminoindan-4-yl]oxytetrahydrofuran-2-one (3S)-3-[(1S)-1-aminoindan-4-yl]o…

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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) -1.47 4.24 -50.22 3 4 1 63 234.275 2 ↓
Hi High (pH 8-9.5) -1.47 3.93 -9.79 2 4 0 62 233.267 2 ↓

Analogs

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Popular Name: (3R)-3-[(1R)-1-aminoindan-4-yl]oxytetrahydrofuran-2-one (3R)-3-[(1R)-1-aminoindan-4-yl]o…

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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) -1.47 4.25 -52.27 3 4 1 63 234.275 2 ↓
Hi High (pH 8-9.5) -1.47 3.95 -11.31 2 4 0 62 233.267 2 ↓

Analogs

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Popular Name: (3S)-3-[(1R)-1-aminoindan-4-yl]oxytetrahydrofuran-2-one (3S)-3-[(1R)-1-aminoindan-4-yl]o…

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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) -1.47 4.24 -53.3 3 4 1 63 234.275 2 ↓
Hi High (pH 8-9.5) -1.47 3.94 -10.75 2 4 0 62 233.267 2 ↓

Analogs

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Popular Name: (3R)-3-[(1R)-1-(methylamino)indan-4-yl]oxytetrahydrofuran-2-one (3R)-3-[(1R)-1-(methylamino)inda…

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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) 0.78 5.9 -45.18 2 4 1 52 248.302 3 ↓
Hi High (pH 8-9.5) 0.78 4.66 -9.64 1 4 0 48 247.294 3 ↓

Analogs

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Popular Name: (3R)-3-[(1S)-1-(methylamino)indan-4-yl]oxytetrahydrofuran-2-one (3R)-3-[(1S)-1-(methylamino)inda…

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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) 0.78 6.05 -47.3 2 4 1 52 248.302 3 ↓
Hi High (pH 8-9.5) 0.78 4.59 -10.68 1 4 0 48 247.294 3 ↓

Analogs

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Popular Name: (3S)-3-[(1R)-1-(methylamino)indan-4-yl]oxytetrahydrofuran-2-one (3S)-3-[(1R)-1-(methylamino)inda…

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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) 0.78 5.9 -47.07 2 4 1 52 248.302 3 ↓
Hi High (pH 8-9.5) 0.78 4.66 -9.62 1 4 0 48 247.294 3 ↓

Analogs

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Popular Name: (3S)-3-[(1S)-1-(methylamino)indan-4-yl]oxytetrahydrofuran-2-one (3S)-3-[(1S)-1-(methylamino)inda…

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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) 0.78 6.05 -46.33 2 4 1 52 248.302 3 ↓
Hi High (pH 8-9.5) 0.78 4.59 -11 1 4 0 48 247.294 3 ↓

Analogs

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Popular Name: (3R)-3-[(1R)-1-(ethylamino)indan-4-yl]oxytetrahydrofuran-2-one (3R)-3-[(1R)-1-(ethylamino)indan…

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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) 1.16 6.74 -43.81 2 4 1 52 262.329 4 ↓

Analogs

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Popular Name: (3R)-3-[(1S)-1-(ethylamino)indan-4-yl]oxytetrahydrofuran-2-one (3R)-3-[(1S)-1-(ethylamino)indan…

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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) 1.16 6.91 -45.78 2 4 1 52 262.329 4 ↓

Analogs

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Popular Name: (3S)-3-[(1R)-1-(ethylamino)indan-4-yl]oxytetrahydrofuran-2-one (3S)-3-[(1R)-1-(ethylamino)indan…

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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) 1.16 6.74 -45.52 2 4 1 52 262.329 4 ↓

Analogs

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Popular Name: (3S)-3-[(1S)-1-(ethylamino)indan-4-yl]oxytetrahydrofuran-2-one (3S)-3-[(1S)-1-(ethylamino)indan…

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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) 1.16 6.9 -44.98 2 4 1 52 262.329 4 ↓

Analogs

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Popular Name: (3R)-3-[(1R)-1-(propylamino)indan-4-yl]oxytetrahydrofuran-2-one (3R)-3-[(1R)-1-(propylamino)inda…

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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) 1.66 7.5 -44.6 2 4 1 52 276.356 5 ↓

Analogs

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Popular Name: (3R)-3-[(1S)-1-(propylamino)indan-4-yl]oxytetrahydrofuran-2-one (3R)-3-[(1S)-1-(propylamino)inda…

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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) 1.66 7.67 -46.63 2 4 1 52 276.356 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-3-[(1R)-1-(propylamino)indan-4-yl]oxytetrahydrofuran-2-one (3S)-3-[(1R)-1-(propylamino)inda…

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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) 1.66 7.5 -46.26 2 4 1 52 276.356 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-3-[(1S)-1-(propylamino)indan-4-yl]oxytetrahydrofuran-2-one (3S)-3-[(1S)-1-(propylamino)inda…

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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) 1.66 7.67 -45.76 2 4 1 52 276.356 5 ↓

Analogs

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Popular Name: (3R)-3-[(1S)-1-hydroxyindan-4-yl]oxytetrahydrofuran-2-one (3R)-3-[(1S)-1-hydroxyindan-4-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) 0.23 3.63 -11.56 1 4 0 56 234.251 2 ↓

Analogs

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Popular Name: (3S)-3-[(1S)-1-hydroxyindan-4-yl]oxytetrahydrofuran-2-one (3S)-3-[(1S)-1-hydroxyindan-4-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) 0.23 3.62 -12.06 1 4 0 56 234.251 2 ↓

Analogs

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Popular Name: (3R)-3-[(1R)-1-hydroxyindan-4-yl]oxytetrahydrofuran-2-one (3R)-3-[(1R)-1-hydroxyindan-4-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) 0.23 3.64 -12.23 1 4 0 56 234.251 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (3S)-3-[(1R)-1-hydroxyindan-4-yl]oxytetrahydrofuran-2-one (3S)-3-[(1R)-1-hydroxyindan-4-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) 0.23 3.63 -11.6 1 4 0 56 234.251 2 ↓

Parameters Provided:

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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 = 273379 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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