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Popular Name: N-cycloheptyl-2-(oxo-phenyl-BLAHyl)acetamide N-cycloheptyl-2-(oxo-phenyl-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) 3.43 10.43 -12.42 1 7 0 82 423.542 4 ↓

Analogs

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Popular Name: N-cycloheptyl-2-(oxo-phenyl-BLAHyl)acetamide N-cycloheptyl-2-(oxo-phenyl-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) 3.43 10.43 -12.12 1 7 0 82 423.542 4 ↓

Analogs

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Popular Name: N-cycloheptyl-2-(m-tolyl-oxo-BLAHyl)acetamide N-cycloheptyl-2-(m-tolyl-oxo-BLA…

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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) 4.07 11.09 -12.1 1 7 0 82 437.569 4 ↓

Analogs

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Popular Name: N-cycloheptyl-2-(m-tolyl-oxo-BLAHyl)acetamide N-cycloheptyl-2-(m-tolyl-oxo-BLA…

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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) 4.07 11.1 -12.42 1 7 0 82 437.569 4 ↓

Analogs

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Popular Name: 2-[(3-chlorophenyl)-oxo-BLAHyl]-N-cycloheptyl-acetamide 2-[(3-chlorophenyl)-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) 4.30 10.95 -11.41 1 7 0 82 457.987 4 ↓

Analogs

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Popular Name: 2-[(3-chlorophenyl)-oxo-BLAHyl]-N-cycloheptyl-acetamide 2-[(3-chlorophenyl)-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) 4.30 10.95 -11.85 1 7 0 82 457.987 4 ↓

Analogs

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Popular Name: 2-[(4-chlorophenyl)-oxo-BLAHyl]-N-cycloheptyl-acetamide 2-[(4-chlorophenyl)-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) 4.11 10.96 -10.27 1 7 0 82 457.987 4 ↓

Analogs

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Popular Name: 2-[(4-chlorophenyl)-oxo-BLAHyl]-N-cycloheptyl-acetamide 2-[(4-chlorophenyl)-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) 4.11 10.96 -10.57 1 7 0 82 457.987 4 ↓

Analogs

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

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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) 3.59 10.5 -10.5 1 7 0 82 441.532 4 ↓

Analogs

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

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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) 3.59 10.5 -10.75 1 7 0 82 441.532 4 ↓

Analogs

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

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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 11.64 -12.68 1 7 0 82 451.596 4 ↓

Analogs

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

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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 11.64 -12.44 1 7 0 82 451.596 4 ↓

Analogs

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

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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 11.91 -11.98 1 7 0 82 451.596 4 ↓

Analogs

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

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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 11.89 -11.99 1 7 0 82 451.596 4 ↓

Analogs

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Popular Name: N-cycloheptyl-2-[oxo-(p-tolyl)BLAHyl]acetamide N-cycloheptyl-2-[oxo-(p-tolyl)BL…

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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) 3.88 11.11 -11.9 1 7 0 82 437.569 4 ↓

Analogs

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Popular Name: N-cycloheptyl-2-[oxo-(p-tolyl)BLAHyl]acetamide N-cycloheptyl-2-[oxo-(p-tolyl)BL…

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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) 3.88 11.11 -12.11 1 7 0 82 437.569 4 ↓

Parameters Provided:

ring.id = 229343
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 = 229343 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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