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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: 6-(5-fluoro-2-methyl-benzoyl)-3,4-dihydro-1H-quinolin-2-one 6-(5-fluoro-2-methyl-benzoyl)-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) 3.60 7.72 -10.43 1 3 0 46 283.302 2 ↓

Analogs

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Popular Name: 6-(2-bromobenzoyl)-1-methyl-3,4-dihydroquinolin-2-one 6-(2-bromobenzoyl)-1-methyl-3,4-…

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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) 3.39 9.39 -10.66 0 3 0 37 344.208 2 ↓

Analogs

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Popular Name: 6-(2-chlorobenzoyl)-1-methyl-3,4-dihydroquinolin-2-one 6-(2-chlorobenzoyl)-1-methyl-3,4…

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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) 3.26 9.29 -10.85 0 3 0 37 299.757 2 ↓

Analogs

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Popular Name: 6-(4-bromobenzoyl)-1-methyl-3,4-dihydroquinolin-2-one 6-(4-bromobenzoyl)-1-methyl-3,4-…

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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) 3.44 9.28 -9.68 0 3 0 37 344.208 2 ↓

Analogs

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Popular Name: 6-(4-fluorobenzoyl)-1-methyl-3,4-dihydroquinolin-2-one 6-(4-fluorobenzoyl)-1-methyl-3,4…

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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) 2.80 8.73 -10.64 0 3 0 37 283.302 2 ↓

Analogs

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Popular Name: 6-(4-chlorobenzoyl)-1-methyl-3,4-dihydroquinolin-2-one 6-(4-chlorobenzoyl)-1-methyl-3,4…

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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) 3.31 9.17 -9.76 0 3 0 37 299.757 2 ↓

Analogs

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Popular Name: 6-(3-chlorobenzoyl)-1-methyl-3,4-dihydroquinolin-2-one 6-(3-chlorobenzoyl)-1-methyl-3,4…

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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) 3.29 9.17 -11.95 0 3 0 37 299.757 2 ↓

Analogs

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Popular Name: 6-(2-fluorobenzoyl)-1-methyl-3,4-dihydroquinolin-2-one 6-(2-fluorobenzoyl)-1-methyl-3,4…

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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) 2.75 8.9 -11.6 0 3 0 37 283.302 2 ↓

Analogs

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Popular Name: 1-methyl-6-(4-methylbenzoyl)-3,4-dihydroquinolin-2-one 1-methyl-6-(4-methylbenzoyl)-3,4…

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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) 3.08 9.31 -10.86 0 3 0 37 279.339 2 ↓

Analogs

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Popular Name: 6-(2-iodobenzoyl)-1-methyl-3,4-dihydroquinolin-2-one 6-(2-iodobenzoyl)-1-methyl-3,4-d…

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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) 3.67 9.82 -10.21 0 3 0 37 391.208 2 ↓

Analogs

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Popular Name: 1-methyl-6-(2-methylbenzoyl)-3,4-dihydroquinolin-2-one 1-methyl-6-(2-methylbenzoyl)-3,4…

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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) 3.03 9.36 -10.17 0 3 0 37 279.339 2 ↓

Analogs

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Popular Name: 6-(3-fluorobenzoyl)-1-methyl-3,4-dihydroquinolin-2-one 6-(3-fluorobenzoyl)-1-methyl-3,4…

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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) 2.77 8.73 -12.71 0 3 0 37 283.302 2 ↓

Analogs

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Popular Name: 1-methyl-6-(3-methylbenzoyl)-3,4-dihydroquinolin-2-one 1-methyl-6-(3-methylbenzoyl)-3,4…

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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) 3.06 9.31 -10.73 0 3 0 37 279.339 2 ↓

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-(3-iodobenzoyl)-1-methyl-3,4-dihydroquinolin-2-one 6-(3-iodobenzoyl)-1-methyl-3,4-d…

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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) 3.69 9.74 -11.15 0 3 0 37 391.208 2 ↓

Analogs

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Popular Name: 6-(4-iodobenzoyl)-1-methyl-3,4-dihydroquinolin-2-one 6-(4-iodobenzoyl)-1-methyl-3,4-d…

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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) 3.72 9.76 -9.88 0 3 0 37 391.208 2 ↓

Analogs

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Popular Name: 6-(3-bromobenzoyl)-1-methyl-3,4-dihydroquinolin-2-one 6-(3-bromobenzoyl)-1-methyl-3,4-…

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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) 3.42 9.28 -11.93 0 3 0 37 344.208 2 ↓

Analogs

34285214
34285214
20002807
20002807

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Popular Name: 6-(2,4-dichlorobenzoyl)-3,4-dihydro-1H-quinolin-2-one 6-(2,4-dichlorobenzoyl)-3,4-dihy…

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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) 4.34 8.08 -9.36 1 3 0 46 320.175 2 ↓

Analogs

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Popular Name: 6-(5-bromo-2-chloro-benzoyl)-3,4-dihydro-1H-quinolin-2-one 6-(5-bromo-2-chloro-benzoyl)-3,4…

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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) 4.47 8.18 -9.66 1 3 0 46 364.626 2 ↓

Parameters Provided:

ring.id = 267229
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 = 267229 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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