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

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[[(3S,6R)-6-methyl-3-piperidyl]methyl]-3-azaspiro[4.6]undecane-2,4-dione 3-[[(3S,6R)-6-methyl-3-piperidyl…

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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) 2.50 7.09 -37.15 2 4 1 54 293.431 2 ↓

Analogs

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Popular Name: 3-[[(3S,6S)-6-methyl-3-piperidyl]methyl]-3-azaspiro[4.6]undecane-2,4-dione 3-[[(3S,6S)-6-methyl-3-piperidyl…

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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) 2.50 7.39 -36.26 2 4 1 54 293.431 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[[(3R,6R)-6-methyl-3-piperidyl]methyl]-3-azaspiro[4.6]undecane-2,4-dione 3-[[(3R,6R)-6-methyl-3-piperidyl…

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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) 2.50 7.17 -36.21 2 4 1 54 293.431 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[[(3R,6S)-6-methyl-3-piperidyl]methyl]-3-azaspiro[4.6]undecane-2,4-dione 3-[[(3R,6S)-6-methyl-3-piperidyl…

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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) 2.50 6.87 -37.06 2 4 1 54 293.431 2 ↓

Analogs

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Popular Name: 2-[2-(2-hydroxyethoxy)ethyl]-2-azaspiro[4.6]undecane-1,3-dione 2-[2-(2-hydroxyethoxy)ethyl]-2-a…

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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) 0.87 2.95 -11.4 1 5 0 67 269.341 5 ↓

Analogs

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Popular Name: 3-[(3-aminophenyl)methyl]-3-azaspiro[4.6]undecane-2,4-dione 3-[(3-aminophenyl)methyl]-3-azas…

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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) 2.06 6.83 -8.05 2 4 0 63 286.375 2 ↓

Analogs

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Popular Name: (2S)-2-(2,4-dioxo-3-azaspiro[4.6]undecan-3-yl)-2-methyl-pentanoic (2S)-2-(2,4-dioxo-3-azaspiro[4.6…

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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) 0.75 8.55 -53.59 0 5 -1 78 294.371 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-2-(2,4-dioxo-3-azaspiro[4.6]undecan-3-yl)-2-methyl-pentanoic (2R)-2-(2,4-dioxo-3-azaspiro[4.6…

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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) 0.75 8.77 -55.1 0 5 -1 78 294.371 4 ↓

Analogs

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Popular Name: 3-[(1S)-3-amino-1-ethyl-propyl]-3-azaspiro[4.6]undecane-2,4-dione 3-[(1S)-3-amino-1-ethyl-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) 1.55 6.02 -44.08 3 4 1 65 267.393 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[(1R)-3-amino-1-ethyl-propyl]-3-azaspiro[4.6]undecane-2,4-dione 3-[(1R)-3-amino-1-ethyl-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) 1.55 5.84 -44.39 3 4 1 65 267.393 4 ↓

Analogs

16991721
16991721
4723006
4723006

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Popular Name: 2-(4-aminocyclohexyl)-2-azaspiro[4.6]undecane-1,3-dione 2-(4-aminocyclohexyl)-2-azaspiro…

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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) 1.41 5.58 -45.86 3 4 1 65 279.404 1 ↓

Analogs

16991721
16991721
4723006
4723006

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Popular Name: 3-[4-(methylamino)cyclohexyl]-3-azaspiro[4.6]undecane-2,4-dione 3-[4-(methylamino)cyclohexyl]-3-…

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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) 2.31 6.88 -36.47 2 4 1 54 293.431 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-(2-amino-1,1-dimethyl-ethyl)-3-azaspiro[4.6]undecane-2,4-dione 3-(2-amino-1,1-dimethyl-ethyl)-3…

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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) 1.23 4.22 -42.87 3 4 1 65 253.366 2 ↓
Hi High (pH 8-9.5) 1.23 3.87 -6.01 2 4 0 63 252.358 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-(1,3-dioxo-2-azaspiro[4.6]undecan-2-yl)pentanoic 5-(1,3-dioxo-2-azaspiro[4.6]unde…

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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 8.23 -52.31 0 5 -1 78 280.344 5 ↓
Lo Low (pH 4.5-6) 1.90 6.25 -11.68 1 5 0 75 281.352 5 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4S)-4-(2,4-dioxo-3-azaspiro[4.6]undecan-3-yl)pentanoic (4S)-4-(2,4-dioxo-3-azaspiro[4.6…

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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) 1.73 8.11 -51.19 0 5 -1 78 280.344 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (4R)-4-(2,4-dioxo-3-azaspiro[4.6]undecan-3-yl)pentanoic (4R)-4-(2,4-dioxo-3-azaspiro[4.6…

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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) 1.73 8.28 -52.06 0 5 -1 78 280.344 4 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-(3-fluoro-4-hydroxy-phenyl)-3-azaspiro[4.6]undecane-2,4-dione 3-(3-fluoro-4-hydroxy-phenyl)-3-…

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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) 2.72 5.61 -12.12 1 4 0 58 291.322 1 ↓
Hi High (pH 8-9.5) 2.72 6.37 -54 0 4 -1 60 290.314 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[4-(hydroxymethyl)phenyl]-3-azaspiro[4.6]undecane-2,4-dione 3-[4-(hydroxymethyl)phenyl]-3-az…

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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 5.74 -12.69 1 4 0 58 287.359 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-(3-hydroxy-2-methyl-phenyl)-3-azaspiro[4.6]undecane-2,4-dione 3-(3-hydroxy-2-methyl-phenyl)-3-…

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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) 3.19 6.51 -11.39 1 4 0 58 287.359 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-(3-hydroxy-4-methyl-phenyl)-3-azaspiro[4.6]undecane-2,4-dione 3-(3-hydroxy-4-methyl-phenyl)-3-…

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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) 3.21 6.31 -12.32 1 4 0 58 287.359 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-(2-fluoro-4-hydroxy-phenyl)-3-azaspiro[4.6]undecane-2,4-dione 3-(2-fluoro-4-hydroxy-phenyl)-3-…

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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) 2.46 5.51 -12.29 1 4 0 58 291.322 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-(4-chloro-3-hydroxy-phenyl)-3-azaspiro[4.6]undecane-2,4-dione 3-(4-chloro-3-hydroxy-phenyl)-3-…

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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) 3.23 6.11 -11.19 1 4 0 58 307.777 1 ↓
Hi High (pH 8-9.5) 3.23 6.87 -54.3 0 4 -1 60 306.769 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-(3-chloro-4-hydroxy-phenyl)-3-azaspiro[4.6]undecane-2,4-dione 3-(3-chloro-4-hydroxy-phenyl)-3-…

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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) 3.23 6.09 -11.32 1 4 0 58 307.777 1 ↓
Hi High (pH 8-9.5) 3.23 6.85 -49.98 0 4 -1 60 306.769 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-(2-chloro-4-hydroxy-phenyl)-3-azaspiro[4.6]undecane-2,4-dione 3-(2-chloro-4-hydroxy-phenyl)-3-…

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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) 2.97 6.2 -11.07 1 4 0 58 307.777 1 ↓
Hi High (pH 8-9.5) 2.97 6.96 -48.9 0 4 -1 60 306.769 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[2-(hydroxymethyl)phenyl]-3-azaspiro[4.6]undecane-2,4-dione 3-[2-(hydroxymethyl)phenyl]-3-az…

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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) 2.13 6.05 -11.76 1 4 0 58 287.359 2 ↓

Analogs

2029685
2029685
2029686
2029686

Draw Identity 99% 90% 80% 70%

Popular Name: 3-prop-2-ynyl-3-azaspiro[4.6]undecane-2,4-dione 3-prop-2-ynyl-3-azaspiro[4.6]und…

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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) 1.77 6.3 -8.57 0 3 0 37 219.284 1 ↓

Analogs

4377601
4377601
4377600
4377600

Draw Identity 99% 90% 80% 70%

Popular Name: 3-(3-ethynylphenyl)-3-azaspiro[4.6]undecane-2,4-dione 3-(3-ethynylphenyl)-3-azaspiro[4…

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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) 2.58 9.6 -12.21 0 3 0 37 281.355 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-(1,3-dioxo-2-azaspiro[4.6]undecan-2-yl)acetonitrile 2-(1,3-dioxo-2-azaspiro[4.6]unde…

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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) 1.40 5.75 -11.38 0 4 0 61 220.272 1 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[2-[(3S)-3-piperidyl]ethyl]-2-azaspiro[4.6]undecane-1,3-dione 2-[2-[(3S)-3-piperidyl]ethyl]-2-…

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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) 2.09 7.45 -40.92 2 4 1 54 293.431 3 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[2-[(3R)-3-piperidyl]ethyl]-2-azaspiro[4.6]undecane-1,3-dione 2-[2-[(3R)-3-piperidyl]ethyl]-2-…

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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) 2.09 7.44 -41.02 2 4 1 54 293.431 3 ↓

Parameters Provided:

ring.id = 17806
filter.purchasability = annotated
page.format = targets
page.num = 1

Structural Results Found: (before additional filtering)

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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 = 17806 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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