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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: 2-[(1R,5S)-2,4-dioxo-3-azabicyclo[3.1.0]hexan-3-yl]-5-nitro-benzoic 2-[(1R,5S)-2,4-dioxo-3-azabicycl…

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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) 1.62 7.47 -54.49 0 8 -1 123 275.196 3 ↓

Analogs

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Popular Name: 2-[(1R,5S)-2,4-dioxo-3-azabicyclo[3.1.0]hexan-3-yl]-4-nitro-benzoic 2-[(1R,5S)-2,4-dioxo-3-azabicycl…

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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) 1.62 7.49 -49.04 0 8 -1 123 275.196 3 ↓

Analogs

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Popular Name: 2-[(1R,5S)-2,4-dioxo-3-azabicyclo[3.1.0]hexan-3-yl]-5-iodo-benzoic 2-[(1R,5S)-2,4-dioxo-3-azabicycl…

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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) 2.75 7.87 -55.81 0 5 -1 78 356.095 2 ↓

Analogs

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Popular Name: 3,5-dibromo-2-[(1R,5S)-2,4-dioxo-3-azabicyclo[3.1.0]hexan-3-yl]benzoic 3,5-dibromo-2-[(1R,5S)-2,4-dioxo…

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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 8.4 -51.76 0 5 -1 78 387.991 2 ↓

Analogs

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Popular Name: 2-[(1R,5S)-2,4-dioxo-3-azabicyclo[3.1.0]hexan-3-yl]-3,5-dimethyl-benzoic 2-[(1R,5S)-2,4-dioxo-3-azabicycl…

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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) 2.49 8.49 -62.32 0 5 -1 78 258.253 2 ↓

Analogs

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Popular Name: 3-bromo-2-[(1R,5S)-2,4-dioxo-3-azabicyclo[3.1.0]hexan-3-yl]benzoic 3-bromo-2-[(1R,5S)-2,4-dioxo-3-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) 2.45 7.88 -58.53 0 5 -1 78 309.095 2 ↓

Analogs

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Popular Name: 5-amino-2-[(1R,5S)-2,4-dioxo-3-azabicyclo[3.1.0]hexan-3-yl]benzoic 5-amino-2-[(1R,5S)-2,4-dioxo-3-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) 0.74 4.65 -61.24 2 6 -1 104 245.214 2 ↓

Analogs

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Popular Name: 4-amino-2-[(1R,5S)-2,4-dioxo-3-azabicyclo[3.1.0]hexan-3-yl]benzoic 4-amino-2-[(1R,5S)-2,4-dioxo-3-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) 0.74 4.66 -62.65 2 6 -1 104 245.214 2 ↓

Analogs

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Popular Name: 3-amino-4-[(1R,5S)-2,4-dioxo-3-azabicyclo[3.1.0]hexan-3-yl]benzoic 3-amino-4-[(1R,5S)-2,4-dioxo-3-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) 0.97 4.76 -57.97 2 6 -1 104 245.214 2 ↓

Analogs

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Popular Name: 4-[(1R,5S)-2,4-dioxo-3-azabicyclo[3.1.0]hexan-3-yl]-3-fluoro-benzoic 4-[(1R,5S)-2,4-dioxo-3-azabicycl…

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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) 1.65 6.53 -53.52 0 5 -1 78 248.189 2 ↓

Analogs

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Popular Name: (1R,5S)-3-[2-(hydroxymethyl)phenyl]-3-azabicyclo[3.1.0]hexane-2,4-dione (1R,5S)-3-[2-(hydroxymethyl)phen…

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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) 0.94 3.64 -13.64 1 4 0 58 217.224 2 ↓

Analogs

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Popular Name: (1R,5S)-3-[2-[(1S)-1-hydroxyethyl]phenyl]-3-azabicyclo[3.1.0]hexane-2,4-dione (1R,5S)-3-[2-[(1S)-1-hydroxyethy…

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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 4.23 -13.42 1 4 0 58 231.251 2 ↓

Analogs

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Popular Name: (1R,5S)-3-[2-[(1R)-1-hydroxyethyl]phenyl]-3-azabicyclo[3.1.0]hexane-2,4-dione (1R,5S)-3-[2-[(1R)-1-hydroxyethy…

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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 4.24 -13.39 1 4 0 58 231.251 2 ↓

Analogs

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Popular Name: (1R,5S)-3-(5-bromo-2-methoxy-phenyl)-3-azabicyclo[3.1.0]hexane-2,4-dione (1R,5S)-3-(5-bromo-2-methoxy-phe…

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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) 2.44 5.89 -13.41 0 4 0 47 296.12 2 ↓

Analogs

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Popular Name: (1R,5S)-3-(3-ethynylphenyl)-3-azabicyclo[3.1.0]hexane-2,4-dione (1R,5S)-3-(3-ethynylphenyl)-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) 1.39 7 -13.4 0 3 0 37 211.22 1 ↓

Analogs

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Popular Name: 5-[(1R,5S)-2,4-dioxo-3-azabicyclo[3.1.0]hexan-3-yl]-2-hydroxy-benzoic 5-[(1R,5S)-2,4-dioxo-3-azabicycl…

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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) 1.56 4.41 -61.67 1 6 -1 98 246.198 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[(1R,5S)-2,4-dioxo-3-azabicyclo[3.1.0]hexan-3-yl]-5-hydroxy-benzoic 2-[(1R,5S)-2,4-dioxo-3-azabicycl…

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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) 1.19 3.92 -59.77 1 6 -1 98 246.198 2 ↓

Parameters Provided:

ring.id = 282343
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 = 282343 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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