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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: N-[(1S,2S)-2-benzyl-3-(2-hydroxyphenyl)-3-oxo-1-phenyl-propyl]benzamide N-[(1S,2S)-2-benzyl-3-(2-hydroxy…

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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) 5.98 13.71 -13.24 2 4 0 66 435.523 8 ↓
Hi High (pH 8-9.5) 5.98 14.72 -56.29 1 4 -1 69 434.515 8 ↓

Analogs

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Popular Name: N-[(1S,2R)-2-benzyl-3-(2-hydroxyphenyl)-3-oxo-1-phenyl-propyl]benzamide N-[(1S,2R)-2-benzyl-3-(2-hydroxy…

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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) 5.98 13.38 -16.9 2 4 0 66 435.523 8 ↓
Hi High (pH 8-9.5) 5.98 14.39 -63.48 1 4 -1 69 434.515 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,2S)-2-benzyl-3-(2-hydroxyphenyl)-3-oxo-1-phenyl-propyl]benzamide N-[(1R,2S)-2-benzyl-3-(2-hydroxy…

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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) 5.98 13.68 -16.09 2 4 0 66 435.523 8 ↓
Hi High (pH 8-9.5) 5.98 14.69 -62.69 1 4 -1 69 434.515 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,2R)-2-benzyl-3-(2-hydroxyphenyl)-3-oxo-1-phenyl-propyl]benzamide N-[(1R,2R)-2-benzyl-3-(2-hydroxy…

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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) 5.98 13.74 -20.28 2 4 0 66 435.523 8 ↓
Hi High (pH 8-9.5) 5.98 14.75 -71.41 1 4 -1 69 434.515 8 ↓

Analogs

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Popular Name: N-[(1S,2S)-2-benzyl-3-oxo-1,3-diphenyl-propyl]benzamide N-[(1S,2S)-2-benzyl-3-oxo-1,3-di…

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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) 6.03 15.59 -16.31 1 3 0 46 419.524 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S,2R)-2-benzyl-3-oxo-1,3-diphenyl-propyl]benzamide N-[(1S,2R)-2-benzyl-3-oxo-1,3-di…

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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) 6.03 14.57 -15.9 1 3 0 46 419.524 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,2S)-2-benzyl-3-oxo-1,3-diphenyl-propyl]benzamide N-[(1R,2S)-2-benzyl-3-oxo-1,3-di…

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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) 6.03 16.1 -11.8 1 3 0 46 419.524 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,2R)-2-benzyl-3-oxo-1,3-diphenyl-propyl]benzamide N-[(1R,2R)-2-benzyl-3-oxo-1,3-di…

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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) 6.03 15 -17.36 1 3 0 46 419.524 8 ↓

Analogs

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Popular Name: N-[(1S,2S)-2-benzyl-3-oxo-1,3-diphenyl-propyl]-2-hydroxy-benzamide N-[(1S,2S)-2-benzyl-3-oxo-1,3-di…

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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) 6.52 13.79 -13.5 2 4 0 66 435.523 8 ↓
Hi High (pH 8-9.5) 6.52 14.8 -56.84 1 4 -1 69 434.515 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S,2R)-2-benzyl-3-oxo-1,3-diphenyl-propyl]-2-hydroxy-benzamide N-[(1S,2R)-2-benzyl-3-oxo-1,3-di…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 6.52 13.39 -16.79 2 4 0 66 435.523 8 ↓
Hi High (pH 8-9.5) 6.52 14.4 -66.76 1 4 -1 69 434.515 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,2S)-2-benzyl-3-oxo-1,3-diphenyl-propyl]-2-hydroxy-benzamide N-[(1R,2S)-2-benzyl-3-oxo-1,3-di…

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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) 6.52 13.68 -15.96 2 4 0 66 435.523 8 ↓
Hi High (pH 8-9.5) 6.52 14.69 -65.81 1 4 -1 69 434.515 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,2R)-2-benzyl-3-oxo-1,3-diphenyl-propyl]-2-hydroxy-benzamide N-[(1R,2R)-2-benzyl-3-oxo-1,3-di…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 6.52 13.75 -20.34 2 4 0 66 435.523 8 ↓
Hi High (pH 8-9.5) 6.52 14.76 -66.88 1 4 -1 69 434.515 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S,2S)-2-benzyl-3-(2-hydroxyphenyl)-3-oxo-1-phenyl-propyl]-2-hydroxy-benzamide N-[(1S,2S)-2-benzyl-3-(2-hydroxy…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 6.46 12.23 -14.59 3 5 0 87 451.522 8 ↓
Hi High (pH 8-9.5) 6.46 13.24 -56.91 2 5 -1 89 450.514 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S,2R)-2-benzyl-3-(2-hydroxyphenyl)-3-oxo-1-phenyl-propyl]-2-hydroxy-benzamide N-[(1S,2R)-2-benzyl-3-(2-hydroxy…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 6.46 11.92 -19.1 3 5 0 87 451.522 8 ↓
Hi High (pH 8-9.5) 6.46 12.93 -66.49 2 5 -1 89 450.514 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,2S)-2-benzyl-3-(2-hydroxyphenyl)-3-oxo-1-phenyl-propyl]-2-hydroxy-benzamide N-[(1R,2S)-2-benzyl-3-(2-hydroxy…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

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) 6.46 12.2 -17.39 3 5 0 87 451.522 8 ↓
Hi High (pH 8-9.5) 6.46 13.21 -63.02 2 5 -1 89 450.514 8 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R,2R)-2-benzyl-3-(2-hydroxyphenyl)-3-oxo-1-phenyl-propyl]-2-hydroxy-benzamide N-[(1R,2R)-2-benzyl-3-(2-hydroxy…

Find On: PubMed — Wikipedia — Google

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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) 6.46 12.27 -22.13 3 5 0 87 451.522 8 ↓
Hi High (pH 8-9.5) 6.46 13.28 -73.21 2 5 -1 89 450.514 8 ↓

Parameters Provided:

ring.id = 606260
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 = 606260 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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