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Popular Name: 2-(oxo-phenyl-BLAHyl)-N-(4-phenoxyphenyl)acetamide 2-(oxo-phenyl-BLAHyl)-N-(4-pheno…

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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) 4.47 13.12 -15.92 1 8 0 91 495.564 6 ↓

Analogs

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Popular Name: 2-(oxo-phenyl-BLAHyl)-N-(4-phenoxyphenyl)acetamide 2-(oxo-phenyl-BLAHyl)-N-(4-pheno…

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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) 4.47 13.07 -15.2 1 8 0 91 495.564 6 ↓

Analogs

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Popular Name: 2-(m-tolyl-oxo-BLAHyl)-N-(4-phenoxyphenyl)acetamide 2-(m-tolyl-oxo-BLAHyl)-N-(4-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) 5.11 13.74 -15.29 1 8 0 91 509.591 6 ↓

Analogs

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Popular Name: 2-(m-tolyl-oxo-BLAHyl)-N-(4-phenoxyphenyl)acetamide 2-(m-tolyl-oxo-BLAHyl)-N-(4-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) 5.11 13.79 -15.92 1 8 0 91 509.591 6 ↓

Analogs

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Popular Name: 2-[(4-fluorophenyl)-oxo-BLAHyl]-N-(4-phenoxyphenyl)acetamide 2-[(4-fluorophenyl)-oxo-BLAHyl]-…

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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) 4.63 13.13 -13.7 1 8 0 91 513.554 6 ↓

Analogs

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Popular Name: 2-[(4-fluorophenyl)-oxo-BLAHyl]-N-(4-phenoxyphenyl)acetamide 2-[(4-fluorophenyl)-oxo-BLAHyl]-…

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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) 4.63 13.2 -13.79 1 8 0 91 513.554 6 ↓

Analogs

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Popular Name: 2-[(3,4-dimethylphenyl)-oxo-BLAHyl]-N-(4-phenoxyphenyl)acetamide 2-[(3,4-dimethylphenyl)-oxo-BLAH…

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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) 5.51 14.27 -15.24 1 8 0 91 523.618 6 ↓

Analogs

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Popular Name: 2-[(3,4-dimethylphenyl)-oxo-BLAHyl]-N-(4-phenoxyphenyl)acetamide 2-[(3,4-dimethylphenyl)-oxo-BLAH…

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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) 5.51 14.33 -16 1 8 0 91 523.618 6 ↓

Analogs

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Popular Name: 2-[(2,4-dimethylphenyl)-oxo-BLAHyl]-N-(4-phenoxyphenyl)acetamide 2-[(2,4-dimethylphenyl)-oxo-BLAH…

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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) 5.51 14.77 -21.33 1 8 0 91 523.618 6 ↓

Analogs

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Popular Name: 2-[(2,4-dimethylphenyl)-oxo-BLAHyl]-N-(4-phenoxyphenyl)acetamide 2-[(2,4-dimethylphenyl)-oxo-BLAH…

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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) 5.51 15 -15.74 1 8 0 91 523.618 6 ↓

Analogs

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Popular Name: 2-[oxo-(p-tolyl)BLAHyl]-N-(4-phenoxyphenyl)acetamide 2-[oxo-(p-tolyl)BLAHyl]-N-(4-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) 4.92 14.03 -21.15 1 8 0 91 509.591 6 ↓

Analogs

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Popular Name: 2-[oxo-(p-tolyl)BLAHyl]-N-(4-phenoxyphenyl)acetamide 2-[oxo-(p-tolyl)BLAHyl]-N-(4-phe…

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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) 4.92 13.81 -15.08 1 8 0 91 509.591 6 ↓

Parameters Provided:

ring.id = 229360
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 = 229360 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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